-ISIS- 10201511232D 22 24 0 0 0 0 0 0 0 0999 V2000 3.9625 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9625 -7.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7458 -8.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5292 -7.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5292 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7458 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -8.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -7.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4458 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4458 -5.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -5.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -5.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2292 -5.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -9.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7458 -9.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2292 -6.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0167 -5.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 13 21 1 0 0 0 0 17 22 1 0 0 0 0 M END > CFN90210 > Diosmetin > 520-34-3 > 98% > C16H12O6 > 300.26 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Diosmetin-CFN90210.html $$$$ -ISIS- 10201511232D 37 40 0 0 0 0 0 0 0 0999 V2000 -1.3167 -7.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3167 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7958 -8.4750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2792 -8.1750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2792 -7.5750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7958 -7.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2417 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 -8.1750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7625 -7.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2417 -7.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2833 -7.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2833 -6.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7625 -6.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2417 -6.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8542 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2042 -6.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8542 -6.4917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8333 -8.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -6.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0375 -5.9208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6375 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6208 -5.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0208 -6.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6083 -6.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8375 -6.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0083 -6.5625 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5917 -6.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8208 -7.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -5.8667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0375 -8.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2833 -6.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2792 -6.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0958 -8.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2833 -8.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4375 -7.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4958 -8.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 2 0 0 0 0 14 19 2 0 0 0 0 17 20 1 1 0 0 0 20 21 1 6 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 2 0 0 0 0 15 31 2 0 0 0 0 12 32 1 1 0 0 0 5 33 1 1 0 0 0 3 34 1 1 0 0 0 8 35 1 1 0 0 0 11 36 1 6 0 0 0 3 37 1 6 0 0 0 M END > CFN90292 > Ganoderic acid D > 108340-60-9 > 98% > C30H42O7 > 514.66 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderic-acid-D-CFN90292.html $$$$ -ISIS- 10201511232D 38 41 0 0 0 0 0 0 0 0999 V2000 -3.2250 -0.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -1.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4333 -1.9083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6333 -1.4542 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6333 -0.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4333 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 -1.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0375 -1.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0375 -0.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 -0.0708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7625 0.8542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0375 1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 0.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 -0.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1792 0.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 1.1375 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0208 -1.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6292 1.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 2.0125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3042 2.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8208 2.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 1.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3333 1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 0.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 1.0292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8417 1.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4583 0.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 2.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -1.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 1.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6333 0.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8875 -2.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 -1.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -0.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9708 -2.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1583 2.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 2 0 0 0 0 14 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 6 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 2 0 0 0 0 15 31 2 0 0 0 0 12 32 1 1 0 0 0 5 33 1 1 0 0 0 3 34 1 1 0 0 0 8 35 1 1 0 0 0 11 36 1 6 0 0 0 3 37 1 6 0 0 0 20 38 1 1 0 0 0 M END > CFN90293 > Ganoderic acid N > 110241-19-5 > 98% > C30H42O8 > 530.65 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderic-acid-N-CFN90293.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 -3.7000 -21.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -22.5083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9042 -22.9667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1083 -22.5083 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1083 -21.5875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9042 -21.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -22.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5125 -22.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5125 -21.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -21.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -21.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2833 -20.2083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5125 -19.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -20.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0792 -19.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8750 -20.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -21.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -19.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1083 -20.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4958 -22.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -22.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0792 -18.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2833 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6708 -18.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -18.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0625 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -19.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8583 -18.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3625 -23.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4458 -23.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0625 -17.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 2 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 2 20 1 1 0 0 0 11 21 1 6 0 0 0 15 22 1 1 0 0 0 22 23 1 6 0 0 0 24 22 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 27 26 2 0 0 0 0 28 27 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 3 31 1 1 0 0 0 3 32 1 6 0 0 0 28 33 2 0 0 0 0 M END > CFN90294 > Ganoderic acid Y > 86377-52-8 > 98% > C30H46O3 > 454.68 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderic-acid-Y-CFN90294.html $$$$ -ISIS- 10201511232D 37 40 0 0 0 0 0 0 0 0999 V2000 -3.2250 -0.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -1.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4333 -1.9083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6333 -1.4542 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6333 -0.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4333 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 -1.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0375 -1.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0375 -0.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 -0.0708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7625 0.8542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0375 1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 0.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 -0.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1792 0.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 1.1375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0208 -1.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6292 1.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 2.0125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3042 2.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8208 2.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 1.5208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3333 1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 0.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 1.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8417 1.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4583 0.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 2.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -1.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 1.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6333 0.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8875 -2.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 -1.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -0.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9708 -2.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 1 1 0 0 0 14 19 2 0 0 0 0 17 20 1 1 0 0 0 20 21 1 6 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 26 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 2 0 0 0 0 15 31 2 0 0 0 0 12 32 1 1 0 0 0 5 33 1 1 0 0 0 3 34 1 1 0 0 0 8 35 2 0 0 0 0 11 36 1 6 0 0 0 3 37 1 6 0 0 0 M END > CFN90295 > Ganoderic acid Z > 294674-09-2 > 98% > C30H42O7 > 514.66 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderic-acid-Z-CFN90295.html $$$$ -ISIS- 10201511232D 37 40 0 0 0 0 0 0 0 0999 V2000 -3.2250 -0.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -1.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4333 -1.9083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6333 -1.4542 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6333 -0.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4333 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 -1.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0375 -1.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0375 -0.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 -0.0708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7625 0.8542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0375 1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 0.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 -0.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1792 0.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 1.1375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0208 -1.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6292 1.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 2.0125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3042 2.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8208 2.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 1.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3333 1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 0.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 1.0292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8417 1.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4583 0.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 2.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -1.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 1.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6333 0.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8875 -2.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 -1.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -0.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9708 -2.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 1 1 0 0 0 14 19 2 0 0 0 0 17 20 1 1 0 0 0 20 21 1 6 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 2 0 0 0 0 15 31 2 0 0 0 0 12 32 1 1 0 0 0 5 33 1 1 0 0 0 3 34 1 1 0 0 0 8 35 2 0 0 0 0 11 36 1 6 0 0 0 3 37 1 6 0 0 0 M END > CFN90296 > Ganoderic acid AM1 > 149507-55-1 > 98% > C30H42O7 > 514.66 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderic-acid-AM1-CFN90296.html $$$$ -ISIS- 10201511232D 37 40 0 0 0 0 0 0 0 0999 V2000 -3.2250 -0.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -1.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4333 -1.9083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6333 -1.4542 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6333 -0.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4333 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 -1.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0375 -1.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0375 -0.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 -0.0708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7625 0.8542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0375 1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 0.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 -0.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1792 0.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 1.1375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0208 -1.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6292 1.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 2.0125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3042 2.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8208 2.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 1.5208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3333 1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 0.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 1.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8417 1.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4583 0.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 2.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -1.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 1.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6333 0.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8875 -2.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 -1.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -0.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9708 -2.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 2 0 0 0 0 14 19 2 0 0 0 0 17 20 1 1 0 0 0 20 21 1 6 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 1 0 0 0 24 26 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 2 0 0 0 0 15 31 2 0 0 0 0 12 32 1 1 0 0 0 5 33 1 1 0 0 0 3 34 1 1 0 0 0 8 35 1 1 0 0 0 11 36 1 6 0 0 0 3 37 1 6 0 0 0 M END > CFN90297 > Ganoderic acid LM2 > 508182-41-0 > 98% > C30H42O7 > 514.66 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderic-acid-LM2-CFN90297.html $$$$ -ISIS- 10201511232D 37 40 0 0 0 0 0 0 0 0999 V2000 -3.0083 -10.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0083 -11.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2125 -12.1917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4125 -11.7333 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4125 -10.8083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2125 -10.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6125 -12.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1792 -11.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1792 -10.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6125 -10.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9792 -10.3500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9792 -9.4292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1792 -8.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6125 -9.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8583 -10.6333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4000 -9.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8583 -9.1458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8042 -12.1917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1417 -8.2708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5250 -7.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0417 -8.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -8.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 -8.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1625 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0625 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8792 -10.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -9.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3458 -8.1917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1417 -11.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4125 -9.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6708 -12.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2167 -11.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -12.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0375 -11.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6542 -11.0167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3208 -12.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2167 -8.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 2 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 1 1 0 0 0 17 19 1 1 0 0 0 19 20 1 6 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 2 0 0 0 0 15 29 1 6 0 0 0 5 30 1 1 0 0 0 3 31 1 1 0 0 0 11 32 1 6 0 0 0 3 33 1 6 0 0 0 29 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 12 37 1 1 0 0 0 M END > CFN90298 > Ganoderic acid TN > 112430-64-5 > 98% > C32H48O5 > 512.73 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderic-acid-TN-CFN90298.html $$$$ -ISIS- 10201511232D 36 39 0 0 0 0 0 0 0 0999 V2000 -3.2250 -0.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -1.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4333 -1.9083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6333 -1.4542 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6333 -0.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4333 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 -1.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0375 -1.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0375 -0.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 -0.0708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7625 0.8542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0375 1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 0.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 -0.3542 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1792 0.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 1.1375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0208 -1.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6292 1.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 2.0125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3042 2.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8208 2.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 1.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3333 1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 0.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 1.0292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8417 1.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4583 0.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 2.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -1.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 1.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6333 0.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8875 -2.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -0.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9708 -2.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 2 0 0 0 0 14 19 2 0 0 0 0 17 20 1 1 0 0 0 20 21 1 6 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 2 0 0 0 0 15 31 1 0 0 0 0 12 32 1 1 0 0 0 5 33 1 1 0 0 0 3 34 1 1 0 0 0 11 35 1 6 0 0 0 3 36 1 6 0 0 0 M END > CFN90299 > Ganolucidic acid A > 98665-21-5 > 98% > C30H44O6 > 500.67 > White cryst. > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganolucidic-acid-A-CFN90299.html $$$$ -ISIS- 10201511232D 37 40 0 0 0 0 0 0 0 0999 V2000 -1.0375 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0375 -9.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2417 -10.0833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5583 -9.6250 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5583 -8.7000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2417 -8.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3583 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1542 -9.6250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1542 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3583 -8.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -8.2417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9542 -7.3167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1542 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3583 -7.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8333 -8.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 -7.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8333 -7.0333 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8333 -10.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5625 -6.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1167 -6.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0167 -5.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6292 -6.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5292 -6.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -7.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1417 -7.1417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0417 -6.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8583 -8.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -7.6333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3250 -6.0792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1167 -9.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -6.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5583 -7.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -10.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -10.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1917 -9.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 -10.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 2 0 0 0 0 14 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 6 0 0 0 20 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 2 0 0 0 0 15 31 2 0 0 0 0 12 32 1 1 0 0 0 5 33 1 1 0 0 0 3 34 1 1 0 0 0 8 35 1 1 0 0 0 11 36 1 6 0 0 0 3 37 1 6 0 0 0 M END > CFN90300 > Ganoderenic acid D > 100665-43-8 > 98% > C30H40O7 > 512.64 > White cryst. > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderenic-acid-D-CFN90300.html $$$$ -ISIS- 10201511232D 37 40 0 0 0 0 0 0 0 0999 V2000 -1.9458 -1.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9458 -2.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -3.3792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3500 -2.9208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3500 -1.9958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1500 -1.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -3.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2458 -2.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2458 -1.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -1.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 -1.5375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0458 -0.6125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2458 -0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -0.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -1.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 -1.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -0.3292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7417 -3.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3458 -0.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2083 0.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5917 1.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1083 0.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7208 0.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6208 0.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4375 -0.8208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2333 -0.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1333 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9500 -1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7500 -0.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4167 0.6250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2083 -2.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 0.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6083 -4.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 -3.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2833 -2.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6875 -4.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 2 0 0 0 0 14 19 2 0 0 0 0 17 20 1 1 0 0 0 20 21 1 6 0 0 0 20 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 6 0 0 0 27 29 1 0 0 0 0 27 30 2 0 0 0 0 15 31 2 0 0 0 0 12 32 1 1 0 0 0 5 33 1 1 0 0 0 3 34 1 1 0 0 0 8 35 2 0 0 0 0 11 36 1 6 0 0 0 3 37 1 6 0 0 0 M END > CFN90301 > Ganoderenic acid F > 120462-47-7 > 98% > C30H38O7 > 510.63 > White cryst. > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderenic-acid-F-CFN90301.html $$$$ -ISIS- 10201511232D 37 40 0 0 0 0 0 0 0 0999 V2000 -1.9458 -1.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9458 -2.9208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1500 -3.3792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3500 -2.9208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3500 -1.9958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1500 -1.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -3.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2458 -2.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2458 -1.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -1.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 -1.5375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0458 -0.6125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2458 -0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -0.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -1.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 -1.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -0.3292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7417 -3.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3458 -0.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2083 0.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5917 1.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1083 0.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7208 0.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6208 0.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4375 -0.8208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2333 -0.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1333 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9500 -1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7500 -0.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4167 0.6250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2083 -2.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 0.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6083 -4.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 -3.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2833 -2.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6875 -4.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 1 1 0 0 0 14 19 2 0 0 0 0 17 20 1 1 0 0 0 20 21 1 6 0 0 0 20 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 6 0 0 0 27 29 1 0 0 0 0 27 30 2 0 0 0 0 15 31 2 0 0 0 0 12 32 1 1 0 0 0 5 33 1 1 0 0 0 3 34 1 1 0 0 0 8 35 2 0 0 0 0 11 36 1 6 0 0 0 3 37 1 6 0 0 0 M END > CFN90302 > Ganoderenic acid H > 120462-48-8 > 98% > C30H40O7 > 512.64 > White cryst. > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderenic-acid-H-CFN90302.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 -2.2250 -10.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -11.6708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4292 -12.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6292 -11.6708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6292 -10.7458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4292 -10.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1708 -12.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9667 -11.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9667 -10.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1708 -10.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7667 -10.2875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7667 -9.3625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9667 -8.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1708 -9.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6458 -10.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1875 -9.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6458 -9.0792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0208 -12.1292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9292 -8.2042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3125 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8292 -8.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -8.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -8.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9542 -9.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8542 -9.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4708 -9.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7667 -8.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6292 -9.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8875 -12.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0042 -11.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9667 -12.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6667 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7625 -12.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 1 0 0 0 0 17 19 1 1 0 0 0 19 20 1 6 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 12 27 1 1 0 0 0 5 28 1 1 0 0 0 3 29 1 1 0 0 0 11 30 1 6 0 0 0 3 31 1 6 0 0 0 24 32 1 0 0 0 0 8 33 2 0 0 0 0 M END > CFN90303 > Ganoderone A > 873061-79-1 > 98% > C30H48O3 > 456.70 > White cryst. > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderone-A-CFN90303.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 -3.7000 -21.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -22.5083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9042 -22.9667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1083 -22.5083 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1083 -21.5875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9042 -21.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -22.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5125 -22.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5125 -21.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -21.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -21.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2833 -20.2083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5125 -19.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -20.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0792 -19.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8750 -20.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -21.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -19.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1083 -20.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4958 -22.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -22.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0792 -18.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2833 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6708 -18.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -18.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0625 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -19.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8583 -18.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3625 -23.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4458 -23.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0625 -17.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 2 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 2 20 1 1 0 0 0 11 21 1 6 0 0 0 15 22 1 1 0 0 0 22 23 1 6 0 0 0 24 22 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 27 26 2 0 0 0 0 28 27 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 3 31 1 1 0 0 0 3 32 1 6 0 0 0 28 33 2 0 0 0 0 M END > CFN90304 > Lucialdehyde A > 420781-84-6 > 98% > C30H46O2 > 438.69 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Lucialdehyde-A-CFN90304.html $$$$ -ISIS- 10201511232D 34 37 0 0 0 0 0 0 0 0999 V2000 -3.7000 -21.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -22.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9042 -22.9667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1083 -22.5083 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1083 -21.5875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9042 -21.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -22.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5125 -22.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5125 -21.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -21.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -21.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2833 -20.2083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5125 -19.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -20.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0792 -19.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8750 -20.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -21.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -19.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1083 -20.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4958 -22.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -22.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0792 -18.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2833 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6708 -18.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -18.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0625 -18.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -19.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8583 -18.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3625 -23.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4458 -23.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0625 -17.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -22.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 2 20 2 0 0 0 0 11 21 1 6 0 0 0 15 22 1 1 0 0 0 22 23 1 6 0 0 0 24 22 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 27 26 2 0 0 0 0 28 27 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 3 31 1 1 0 0 0 3 32 1 6 0 0 0 28 33 2 0 0 0 0 8 34 2 0 0 0 0 M END > CFN90305 > Lucialdehyde B > 480439-84-7 > 98% > C30H44O3 > 452.67 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Lucialdehyde-B-CFN90305.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 -2.2250 -10.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -11.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4292 -12.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6292 -11.6708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6292 -10.7458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4292 -10.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1708 -12.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9667 -11.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9667 -10.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1708 -10.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7667 -10.2875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7667 -9.3625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9667 -8.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1708 -9.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6458 -10.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1875 -9.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6458 -9.0792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0208 -12.1292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9292 -8.2042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3125 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8292 -8.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -8.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -8.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9542 -9.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8542 -9.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4708 -9.6792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1375 -8.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7667 -8.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6292 -9.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8875 -12.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0042 -11.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9667 -12.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6667 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 2 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 2 0 0 0 0 17 19 1 1 0 0 0 19 20 1 6 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 12 28 1 1 0 0 0 5 29 1 1 0 0 0 3 30 1 1 0 0 0 11 31 1 6 0 0 0 3 32 1 6 0 0 0 24 33 1 0 0 0 0 M END > CFN90306 > Ganoderal A > 104700-98-3 > 98% > C30H44O2 > 436.68 > White cryst. > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderal-A-CFN90306.html $$$$ -ISIS- 10201511232D 91 99 0 0 0 0 0 0 0 0999 V2000 2.4167 -8.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4167 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -9.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6750 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -8.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3042 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -7.6083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9333 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -8.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -7.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4792 -6.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5625 -6.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7917 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6792 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4083 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5625 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1792 -6.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6958 -7.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3958 -6.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9083 -7.3667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6125 -7.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7250 -8.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2167 -5.7917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 -5.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4750 -5.0667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -4.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2167 -5.0667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1000 -6.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1000 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7292 -5.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1625 -9.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1625 -8.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0958 -8.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -9.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -8.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -10.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -6.5208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5333 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -5.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0958 -5.0708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7250 -5.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7250 -6.1583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1625 -5.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3542 -5.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -4.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3542 -6.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1625 -4.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -3.9792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2125 -3.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -2.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -2.5208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9500 -2.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9500 -3.6167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3542 -6.1542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3500 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.9792 -7.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.6125 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6125 -6.1542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.9792 -5.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -2.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3208 -2.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9792 -7.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -5.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -1.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -1.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8708 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 2 0 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 21 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 59 58 1 1 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 59 1 0 0 0 0 61 65 1 1 0 0 0 63 66 1 1 0 0 0 62 67 1 6 0 0 0 64 68 1 6 0 0 0 65 69 1 0 0 0 0 70 45 1 1 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 70 1 0 0 0 0 76 47 1 6 0 0 0 76 77 1 0 0 0 0 77 78 1 0 0 0 0 78 79 1 0 0 0 0 79 80 1 0 0 0 0 80 81 1 0 0 0 0 81 76 1 0 0 0 0 72 82 1 1 0 0 0 74 83 1 1 0 0 0 77 84 1 1 0 0 0 79 85 1 1 0 0 0 78 86 1 6 0 0 0 80 87 1 6 0 0 0 73 88 1 6 0 0 0 75 89 1 6 0 0 0 82 90 1 0 0 0 0 87 91 1 0 0 0 0 M END > CFN90365 > 11-Oxo-mogroside V > 126105-11-1 > 98% > C60H100O29 > 1285.42 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/11-Oxo-mogroside-V-CFN90365.html $$$$ -ISIS- 10201511232D 30 33 0 0 0 0 0 0 0 0999 V2000 -0.4500 -8.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3375 -8.5958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1208 -8.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1208 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3375 -6.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -8.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6958 -8.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6958 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -6.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2417 -6.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0292 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0292 -8.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2417 -8.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3375 -5.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8125 -8.5958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8125 -6.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -5.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4792 -8.5958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -9.5042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1208 -9.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1208 -10.8667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9083 -11.3208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6958 -10.8667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6958 -9.9583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3333 -11.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4833 -11.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -12.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4833 -9.5042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3333 -12.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 2 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 2 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 1 1 0 0 0 0 6 15 2 0 0 0 0 13 16 1 0 0 0 0 12 17 1 0 0 0 0 10 18 1 0 0 0 0 8 19 1 0 0 0 0 20 7 1 1 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 20 1 0 0 0 0 22 26 1 1 0 0 0 24 27 1 1 0 0 0 23 28 1 6 0 0 0 25 29 1 6 0 0 0 26 30 1 0 0 0 0 M END > CFN90385 > Isomangiferin > 24699-16-9 > 98% > C19H18O11 > 422.34 > Yellow cryst. > Xanthones > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Isomangiferin-CFN90385.html $$$$ -ISIS- 10201511232D 80 87 0 0 0 0 0 0 0 0999 V2000 1.4750 -7.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -8.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1292 -8.9375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7792 -8.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -7.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1292 -7.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -8.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -8.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -7.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4292 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7292 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7292 -6.6833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0792 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -6.6833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4417 -7.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -7.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -6.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6750 -5.7375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7292 -5.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8292 -8.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -9.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -9.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -7.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -6.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -5.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -5.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6583 -5.9000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1875 -6.4333 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9125 -6.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -7.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7208 -6.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -5.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -7.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5042 -4.8042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1500 -5.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8042 -4.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8042 -4.0542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1500 -3.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5042 -4.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4500 -5.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -2.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1042 -4.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1792 -8.5583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1792 -7.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1208 -7.8083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1208 -8.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4708 -8.9333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4708 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7708 -8.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7708 -7.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -9.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -6.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -5.5583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4708 -5.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -4.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1208 -4.0583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7708 -4.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7708 -5.1833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1792 -4.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4208 -4.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -3.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4208 -5.5583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1792 -3.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -2.9292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5000 -2.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 -1.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8500 -1.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1958 -1.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1958 -2.5542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1500 -1.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5458 -1.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -0.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -2.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -0.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 1 6 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 21 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 59 58 1 1 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 59 1 0 0 0 0 61 65 1 1 0 0 0 63 66 1 1 0 0 0 62 67 1 6 0 0 0 64 68 1 6 0 0 0 65 69 1 0 0 0 0 70 45 1 1 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 70 1 0 0 0 0 72 76 1 1 0 0 0 74 77 1 1 0 0 0 73 78 1 6 0 0 0 75 79 1 6 0 0 0 76 80 1 0 0 0 0 M END > CFN90389 > Mogroside IV > 89590-95-4 > 98% > C54H92O24 > 1125.31 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Mogroside-IV-CFN90389.html $$$$ -ISIS- 10201511232D 80 87 0 0 0 0 0 0 0 0999 V2000 1.4750 -7.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -8.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1292 -8.9375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7792 -8.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -7.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1292 -7.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -8.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -8.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -7.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4292 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7292 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7292 -6.6833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0792 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -6.6833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4417 -7.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -7.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -6.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6750 -5.7375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7292 -5.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8292 -8.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -9.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -9.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -7.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -6.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -5.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -5.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6583 -5.9000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1875 -6.4333 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9125 -6.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -7.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7208 -6.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -5.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -7.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5042 -4.8042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1500 -5.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8042 -4.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8042 -4.0542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1500 -3.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5042 -4.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4500 -5.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -2.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1042 -4.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1792 -8.5583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1792 -7.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1208 -7.8083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1208 -8.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4708 -8.9333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4708 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7708 -8.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7708 -7.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -9.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -6.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -5.5583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4708 -5.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -4.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1208 -4.0583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7708 -4.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7708 -5.1833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1792 -4.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4208 -4.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -3.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4208 -5.5583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1792 -3.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -2.9292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5000 -2.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 -1.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8500 -1.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1958 -1.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1958 -2.5542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1500 -1.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5458 -1.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -0.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -2.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -0.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 1 6 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 21 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 59 58 1 1 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 59 1 0 0 0 0 61 65 1 1 0 0 0 63 66 1 1 0 0 0 62 67 1 6 0 0 0 64 68 1 6 0 0 0 65 69 1 0 0 0 0 70 45 1 1 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 70 1 0 0 0 0 72 76 1 1 0 0 0 74 77 1 1 0 0 0 73 78 1 6 0 0 0 75 79 1 6 0 0 0 76 80 1 0 0 0 0 M END > CFN90389 > Mogroside IV > 89590-95-4 > 98% > C54H92O24 > 1125.31 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Mogroside-IV-CFN90389.html $$$$ -ISIS- 10201511232D 102111 0 0 0 0 0 0 0 0999 V2000 2.4167 -8.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4167 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -9.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6750 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -8.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3042 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -7.6083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9333 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -7.6083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2542 -8.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -7.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4792 -6.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5625 -6.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7917 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6792 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4083 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5625 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1792 -6.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6958 -7.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3958 -6.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9083 -7.3667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6125 -7.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7250 -8.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2167 -5.7917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 -5.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4750 -5.0667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -4.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2167 -5.0667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1000 -6.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1000 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7292 -5.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1625 -9.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1625 -8.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0958 -8.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -9.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -8.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -10.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -6.5208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5333 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -5.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0958 -5.0708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7250 -5.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7250 -6.1583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1625 -5.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3542 -5.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -4.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3542 -6.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1625 -4.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -3.9792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2125 -3.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -2.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -2.5208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9500 -2.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9500 -3.6167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3542 -6.1542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3500 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.9792 -7.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.6125 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6125 -6.1542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.9792 -5.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -2.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3208 -2.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9792 -7.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -5.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -1.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -1.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8708 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -10.8750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7250 -10.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3542 -10.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3542 -11.6000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7250 -11.9625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0958 -11.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9833 -10.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -12.6875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9833 -11.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -11.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6083 -10.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 1 6 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 21 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 59 58 1 1 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 59 1 0 0 0 0 61 65 1 1 0 0 0 63 66 1 1 0 0 0 62 67 1 6 0 0 0 64 68 1 6 0 0 0 65 69 1 0 0 0 0 70 45 1 1 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 70 1 0 0 0 0 76 47 1 6 0 0 0 76 77 1 0 0 0 0 77 78 1 0 0 0 0 78 79 1 0 0 0 0 79 80 1 0 0 0 0 80 81 1 0 0 0 0 81 76 1 0 0 0 0 72 82 1 1 0 0 0 74 83 1 1 0 0 0 77 84 1 1 0 0 0 79 85 1 1 0 0 0 78 86 1 6 0 0 0 80 87 1 6 0 0 0 73 88 1 6 0 0 0 75 89 1 6 0 0 0 82 90 1 0 0 0 0 87 91 1 0 0 0 0 92 57 1 1 0 0 0 92 93 1 0 0 0 0 93 94 1 0 0 0 0 94 95 1 0 0 0 0 95 96 1 0 0 0 0 96 97 1 0 0 0 0 97 92 1 0 0 0 0 94 98 1 1 0 0 0 96 99 1 1 0 0 0 95100 1 6 0 0 0 97101 1 6 0 0 0 98102 1 0 0 0 0 M END > CFN90436 > Mogroside VI > 89590-98-7 > 98% > C66H112O34 > 1449.59 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Mogroside-VI-CFN90436.html $$$$ -ISIS- 10201511232D 23 24 0 0 0 0 0 0 0 0999 V2000 -3.7375 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7375 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 0.8708 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2208 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 3.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 2.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5292 0.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -1.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 2.0167 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 13 22 1 0 0 0 0 M CHG 2 10 1 23 -1 M END > CFN92033 > Delphinidin chloride > 528-53-0 > 98% > C15H11ClO7 > 338.7 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Delphinidin-chloride-CFN92033.html $$$$ -ISIS- 10201511232D 23 24 0 0 0 0 0 0 0 0999 V2000 -3.7375 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7375 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 0.8708 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2208 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 3.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 2.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5292 0.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -1.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 2.0167 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 13 22 1 0 0 0 0 M CHG 2 10 1 23 -1 M END > CFN92033 > Delphinidin chloride > 528-53-0 > 98% > C15H11ClO7 > 338.7 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Delphinidin-chloride-CFN92033.html $$$$ -ISIS- 10201511232D 23 24 0 0 0 0 0 0 0 0999 V2000 -3.7375 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7375 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 0.8708 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2208 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 3.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 2.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5292 0.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -1.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 3.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 2.0167 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 17 22 1 0 0 0 0 M CHG 2 10 1 23 -1 M END > CFN92034 > Peonidin chloride > 134-01-0 > 98% > C16H13ClO6 > 336.7 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Peonidin-chloride-CFN92034.html $$$$ -ISIS- 10201511232D 23 24 0 0 0 0 0 0 0 0999 V2000 -3.7375 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7375 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 0.8708 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2208 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 3.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 2.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5292 0.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -1.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 3.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 2.0167 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 17 22 1 0 0 0 0 M CHG 2 10 1 23 -1 M END > CFN92034 > Peonidin chloride > 134-01-0 > 98% > C16H13ClO6 > 336.7 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Peonidin-chloride-CFN92034.html $$$$ -ISIS- 10201511232D 25 26 0 0 0 0 0 0 0 0999 V2000 -3.7375 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7375 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 0.8708 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2208 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 2.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5292 0.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -1.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 3.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3917 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 2.0167 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 8 20 1 0 0 0 0 15 21 1 0 0 0 0 21 22 1 0 0 0 0 13 23 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 2 10 1 25 -1 M END > CFN92035 > Malvidin chloride > 643-84-5 > 98% > C17H15ClO7 > 366.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Malvidin-chloride-CFN92035.html $$$$ -ISIS- 10201511232D 25 26 0 0 0 0 0 0 0 0999 V2000 -3.7375 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7375 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 0.8708 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2208 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 2.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5292 0.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -1.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 3.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3917 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 2.0167 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 8 20 1 0 0 0 0 15 21 1 0 0 0 0 21 22 1 0 0 0 0 13 23 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 2 10 1 25 -1 M END > CFN92035 > Malvidin chloride > 643-84-5 > 98% > C17H15ClO7 > 366.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Malvidin-chloride-CFN92035.html $$$$ -ISIS- 10201511232D 24 25 0 0 0 0 0 0 0 0999 V2000 -3.7375 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7375 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 0.8708 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2208 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 2.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5292 0.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -1.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 3.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 2.0167 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 8 20 1 0 0 0 0 15 21 1 0 0 0 0 21 22 1 0 0 0 0 13 23 1 0 0 0 0 M CHG 2 10 1 24 -1 M END > CFN92036 > Petunidin chloride > 1429-30-7 > 98% > C16H13ClO7 > 352.7 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Petunidin-chloride-CFN92036.html $$$$ -ISIS- 10201511232D 24 25 0 0 0 0 0 0 0 0999 V2000 -3.7375 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7375 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 0.8708 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2208 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 2.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5292 0.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -1.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 3.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 2.0167 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 8 20 1 0 0 0 0 15 21 1 0 0 0 0 21 22 1 0 0 0 0 13 23 1 0 0 0 0 M CHG 2 10 1 24 -1 M END > CFN92036 > Petunidin chloride > 1429-30-7 > 98% > C16H13ClO7 > 352.7 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Petunidin-chloride-CFN92036.html $$$$ -ISIS- 10201511232D 34 36 0 0 0 0 0 0 0 0999 V2000 -3.6750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -7.2542 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -5.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4667 -7.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -9.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -10.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5083 -10.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2875 -11.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -10.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8667 -11.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -10.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -7.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -11.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4125 -6.1083 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 13 31 1 0 0 0 0 24 32 1 1 0 0 0 32 33 1 0 0 0 0 M CHG 2 10 1 34 -1 M END > CFN92037 > Delphinidin-3-O-galactoside chloride > 28500-00-7 > 98% > C21H21ClO12 > 500.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Delphinidin-3-O-galactoside-chloride-CFN92037.html $$$$ -ISIS- 10201511232D 34 36 0 0 0 0 0 0 0 0999 V2000 -3.6750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -7.2542 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -5.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4667 -7.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -9.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -10.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5083 -10.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2875 -11.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -10.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8667 -11.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -10.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -7.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -11.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4125 -6.1083 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 13 31 1 0 0 0 0 24 32 1 1 0 0 0 32 33 1 0 0 0 0 M CHG 2 10 1 34 -1 M END > CFN92037 > Delphinidin-3-O-galactoside chloride > 28500-00-7 > 98% > C21H21ClO12 > 500.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Delphinidin-3-O-galactoside-chloride-CFN92037.html $$$$ -ISIS- 10201511232D 34 36 0 0 0 0 0 0 0 0999 V2000 7.7625 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -8.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -8.0958 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.7208 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -6.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7208 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -5.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -6.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -8.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -10.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -9.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -10.8417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9292 -11.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7250 -12.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5167 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5167 -11.3000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3042 -12.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -13.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -10.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -12.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -13.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -6.9542 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 6 0 0 0 27 30 1 6 0 0 0 13 31 1 0 0 0 0 24 32 1 1 0 0 0 32 33 1 0 0 0 0 M CHG 2 10 1 34 -1 M END > CFN92038 > Delphinidin-3-O-glucoside chloride > 6906-38-3 > 98% > C21H21ClO12 > 500.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Delphinidin-3-O-glucoside-chloride-CFN92038.html $$$$ -ISIS- 10201511232D 34 36 0 0 0 0 0 0 0 0999 V2000 7.7625 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -8.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -8.0958 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.7208 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -6.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7208 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -5.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -6.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -8.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -10.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -9.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -10.8417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9292 -11.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7250 -12.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5167 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5167 -11.3000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3042 -12.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -13.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -10.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -12.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -13.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -6.9542 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 6 0 0 0 27 30 1 6 0 0 0 13 31 1 0 0 0 0 24 32 1 1 0 0 0 32 33 1 0 0 0 0 M CHG 2 10 1 34 -1 M END > CFN92038 > Delphinidin-3-O-glucoside chloride > 6906-38-3 > 98% > C21H21ClO12 > 500.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Delphinidin-3-O-glucoside-chloride-CFN92038.html $$$$ -ISIS- 10201511232D 32 34 0 0 0 0 0 0 0 0999 V2000 -1.7375 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7375 -6.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9458 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1542 -6.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1542 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9458 -5.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6375 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4292 -6.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4292 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6375 -5.1583 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 2.2208 -5.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0125 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -5.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -4.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0125 -3.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2208 -4.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0125 -2.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -3.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5292 -5.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9458 -7.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -6.9875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -7.9042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4292 -8.3625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4292 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0167 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0167 -8.3625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8042 -9.7333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -10.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -7.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -5.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -4.0167 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 13 31 1 0 0 0 0 M CHG 2 10 1 32 -1 M END > CFN92039 > Delphinidin-3-O-arabinoside chloride > 171370-55-1 > 98% > C20H19ClO11 > 470.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Delphinidin-3-O-arabinoside-chloride-CFN92039.html $$$$ -ISIS- 10201511232D 32 34 0 0 0 0 0 0 0 0999 V2000 -1.7375 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7375 -6.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9458 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1542 -6.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1542 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9458 -5.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6375 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4292 -6.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4292 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6375 -5.1583 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 2.2208 -5.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0125 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -5.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -4.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0125 -3.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2208 -4.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0125 -2.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -3.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5292 -5.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9458 -7.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -6.9875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -7.9042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4292 -8.3625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4292 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0167 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0167 -8.3625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8042 -9.7333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -10.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -7.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -5.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -4.0167 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 13 31 1 0 0 0 0 M CHG 2 10 1 32 -1 M END > CFN92039 > Delphinidin-3-O-arabinoside chloride > 171370-55-1 > 98% > C20H19ClO11 > 470.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Delphinidin-3-O-arabinoside-chloride-CFN92039.html $$$$ -ISIS- 10201511232D 33 35 0 0 0 0 0 0 0 0999 V2000 -3.6750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -7.2542 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -5.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4667 -7.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -9.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -10.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5083 -10.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2875 -11.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -10.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8667 -11.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -10.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -11.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4125 -6.1083 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 M CHG 2 10 1 33 -1 M END > CFN92040 > Cyanidin-3-O-galactoside chloride > 27661-36-5 > 98% > C21H21ClO11 > 484.9 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Cyanidin-3-O-galactoside-chloride-CFN92040.html $$$$ -ISIS- 10201511232D 33 35 0 0 0 0 0 0 0 0999 V2000 -3.6750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -7.2542 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -5.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4667 -7.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -9.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -10.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5083 -10.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2875 -11.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -10.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8667 -11.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -10.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -11.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4125 -6.1083 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 M CHG 2 10 1 33 -1 M END > CFN92040 > Cyanidin-3-O-galactoside chloride > 27661-36-5 > 98% > C21H21ClO11 > 484.9 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Cyanidin-3-O-galactoside-chloride-CFN92040.html $$$$ -ISIS- 10201511232D 31 33 0 0 0 0 0 0 0 0999 V2000 -2.2542 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2542 -5.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7333 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2167 -5.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2167 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7333 -4.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6958 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -5.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6958 -4.2750 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.3417 -4.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8625 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3833 -4.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3833 -3.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8625 -3.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3417 -3.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8625 -2.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -3.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7708 -4.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7333 -6.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3458 -5.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3458 -6.0750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1750 -6.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -6.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3458 -7.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8625 -6.9750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8625 -6.3750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3833 -7.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3458 -7.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3833 -6.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7708 -3.5250 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 M CHG 2 10 1 31 -1 M END > CFN92041 > Cyanidin-3-O-arabinoside chloride > 111613-04-8 > 98% > C20H19ClO10 > 454.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Cyanidin-3-O-arabinoside-chloride-CFN92041.html $$$$ -ISIS- 10201511232D 31 33 0 0 0 0 0 0 0 0999 V2000 -2.2542 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2542 -5.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7333 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2167 -5.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2167 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7333 -4.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6958 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -5.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6958 -4.2750 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.3417 -4.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8625 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3833 -4.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3833 -3.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8625 -3.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3417 -3.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8625 -2.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -3.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7708 -4.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7333 -6.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3458 -5.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3458 -6.0750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1750 -6.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -6.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3458 -7.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8625 -6.9750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8625 -6.3750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3833 -7.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3458 -7.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3833 -6.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7708 -3.5250 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 M CHG 2 10 1 31 -1 M END > CFN92041 > Cyanidin-3-O-arabinoside chloride > 111613-04-8 > 98% > C20H19ClO10 > 454.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Cyanidin-3-O-arabinoside-chloride-CFN92041.html $$$$ -ISIS- 10201511232D 35 37 0 0 0 0 0 0 0 0999 V2000 -3.6750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -7.2542 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -5.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4667 -7.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -9.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -10.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5083 -10.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2875 -11.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -10.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8667 -11.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -10.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -11.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -4.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -7.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4125 -6.1083 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 17 33 1 0 0 0 0 13 34 1 0 0 0 0 M CHG 2 10 1 35 -1 M END > CFN92042 > Petunidin-3-O-galactoside chloride > 28500-02-9 > 98% > C22H23ClO12 > 514.9 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Petunidin-3-O-galactoside-chloride-CFN92042.html $$$$ -ISIS- 10201511232D 35 37 0 0 0 0 0 0 0 0999 V2000 -3.6750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -7.2542 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -5.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4667 -7.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -9.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -10.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5083 -10.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2875 -11.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -10.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8667 -11.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -10.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -11.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -4.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -7.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4125 -6.1083 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 17 33 1 0 0 0 0 13 34 1 0 0 0 0 M CHG 2 10 1 35 -1 M END > CFN92042 > Petunidin-3-O-galactoside chloride > 28500-02-9 > 98% > C22H23ClO12 > 514.9 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Petunidin-3-O-galactoside-chloride-CFN92042.html $$$$ -ISIS- 10201511232D 35 37 0 0 0 0 0 0 0 0999 V2000 7.7625 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -8.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -8.0958 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.7208 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -6.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7208 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -6.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -8.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -10.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -9.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -10.8417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9292 -11.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7250 -12.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5167 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5167 -11.3000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3042 -12.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -13.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -10.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -12.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -13.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -5.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -6.9542 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 8 20 1 0 0 0 0 21 20 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 25 27 1 1 0 0 0 24 28 1 6 0 0 0 26 29 1 6 0 0 0 23 30 1 1 0 0 0 30 31 1 0 0 0 0 15 32 1 0 0 0 0 32 33 1 0 0 0 0 13 34 1 0 0 0 0 M CHG 2 10 1 35 -1 M END > CFN92043 > Petunidin-3-O-glucoside chloride > 6988-81-4 > 98% > C22H23ClO12 > 514.9 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Petunidin-3-O-glucoside-chloride-CFN92043.html $$$$ -ISIS- 10201511232D 35 37 0 0 0 0 0 0 0 0999 V2000 7.7625 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -8.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -8.0958 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.7208 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -6.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7208 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -6.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -8.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -10.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -9.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -10.8417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9292 -11.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7250 -12.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5167 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5167 -11.3000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3042 -12.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -13.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -10.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -12.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -13.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -5.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -6.9542 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 8 20 1 0 0 0 0 21 20 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 25 27 1 1 0 0 0 24 28 1 6 0 0 0 26 29 1 6 0 0 0 23 30 1 1 0 0 0 30 31 1 0 0 0 0 15 32 1 0 0 0 0 32 33 1 0 0 0 0 13 34 1 0 0 0 0 M CHG 2 10 1 35 -1 M END > CFN92043 > Petunidin-3-O-glucoside chloride > 6988-81-4 > 98% > C22H23ClO12 > 514.9 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Petunidin-3-O-glucoside-chloride-CFN92043.html $$$$ -ISIS- 10201511232D 33 35 0 0 0 0 0 0 0 0999 V2000 7.9792 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9792 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 -0.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5667 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5667 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 1.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 -0.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 1.0292 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.9375 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 2.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9375 1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 3.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3125 2.3958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1917 1.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 -1.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -0.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -1.7167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1500 -2.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -3.5458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7333 -3.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7333 -2.1750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.5250 -3.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -4.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 -1.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 3.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3167 0.5708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 2.1708 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 17 31 1 0 0 0 0 13 32 1 0 0 0 0 M CHG 2 10 1 33 -1 M END > CFN92044 > Petunidin-3-O-arabinoside chloride > 28500-03-0 > 98% > C21H21ClO11 > 484.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Petunidin-3-O-arabinoside-chloride-CFN92044.html $$$$ -ISIS- 10201511232D 33 35 0 0 0 0 0 0 0 0999 V2000 7.9792 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9792 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 -0.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5667 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5667 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 1.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 -0.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 1.0292 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.9375 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 2.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9375 1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 3.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3125 2.3958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1917 1.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 -1.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -0.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -1.7167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1500 -2.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -3.5458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7333 -3.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7333 -2.1750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.5250 -3.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -4.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 -1.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 3.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3167 0.5708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 2.1708 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 17 31 1 0 0 0 0 13 32 1 0 0 0 0 M CHG 2 10 1 33 -1 M END > CFN92044 > Petunidin-3-O-arabinoside chloride > 28500-03-0 > 98% > C21H21ClO11 > 484.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Petunidin-3-O-arabinoside-chloride-CFN92044.html $$$$ -ISIS- 10201511232D 34 36 0 0 0 0 0 0 0 0999 V2000 -3.6750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -7.2542 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -5.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4667 -7.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -9.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -10.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5083 -10.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2875 -11.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -10.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8667 -11.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -10.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -11.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -4.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4125 -6.1083 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 17 33 1 0 0 0 0 M CHG 2 10 1 34 -1 M END > CFN92045 > Peonidin-3-O-galactoside chloride > 28148-89-2 > 98% > C22H23ClO11 > 498.9 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Peonidin-3-O-galactoside-chloride-CFN92045.html $$$$ -ISIS- 10201511232D 34 36 0 0 0 0 0 0 0 0999 V2000 7.7625 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -8.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -8.0958 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.7208 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -6.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7208 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -5.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -6.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -8.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -10.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -9.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -10.8417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9292 -11.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7250 -12.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5167 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5167 -11.3000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3042 -12.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -13.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -10.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -12.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -13.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -5.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -6.9542 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 6 0 0 0 27 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 17 33 1 0 0 0 0 M CHG 2 10 1 34 -1 M END > CFN92046 > Peonidin-3-O-glucoside chloride > 6906-39-4 > 98% > C22H23ClO11 > 498.9 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Peonidin-3-O-glucoside-chloride-CFN92046.html $$$$ -ISIS- 10201511232D 32 34 0 0 0 0 0 0 0 0999 V2000 7.9792 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9792 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 -0.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5667 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5667 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 1.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 -0.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 1.0292 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.9375 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 2.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9375 1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 3.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3125 2.3958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1917 1.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 -1.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -0.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -1.7167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1500 -2.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -3.5458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7333 -3.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7333 -2.1750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.5250 -3.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -4.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 -1.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 3.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 2.1708 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 17 31 1 0 0 0 0 M CHG 2 10 1 32 -1 M END > CFN92047 > Peonidin-3-O-arabinoside chloride > 524943-91-7 > 98% > C21H21ClO10 > 468.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Peonidin-3-O-arabinoside-chloride-CFN92047.html $$$$ -ISIS- 10201511232D 36 38 0 0 0 0 0 0 0 0999 V2000 -3.6750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -8.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -7.2542 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2833 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 -6.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -5.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4667 -7.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -9.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -9.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -10.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5083 -10.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2875 -11.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -11.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0792 -10.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8667 -11.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -10.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -11.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -12.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -4.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -7.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4542 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4125 -6.1083 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 17 33 1 0 0 0 0 13 34 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 2 10 1 36 -1 M END > CFN92048 > Malvidin-3-O-galactoside chloride > 30113-37-2 > 98% > C23H25ClO12 > 528.9 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Malvidin-3-O-galactoside-chloride-CFN92048.html $$$$ -ISIS- 10201511232D 36 38 0 0 0 0 0 0 0 0999 V2000 7.7625 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -8.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -8.0958 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.7208 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -6.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7208 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -6.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -8.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -10.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -9.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -10.8417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9292 -11.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7250 -12.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5167 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5167 -11.3000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3042 -12.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -13.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -10.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -12.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -13.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -5.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8917 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -6.9542 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 8 20 1 0 0 0 0 21 20 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 25 27 1 1 0 0 0 24 28 1 6 0 0 0 26 29 1 6 0 0 0 23 30 1 1 0 0 0 30 31 1 0 0 0 0 15 32 1 0 0 0 0 32 33 1 0 0 0 0 13 34 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 2 10 1 36 -1 M END > CFN92049 > Malvidin-3-O-glucoside chloride > 7228-78-6 > 98% > C23H25ClO12 > 528.9 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Malvidin-3-O-glucoside-chloride-CFN92049.html $$$$ -ISIS- 10201511232D 34 36 0 0 0 0 0 0 0 0999 V2000 7.9792 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9792 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 -0.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5667 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5667 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 1.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 -0.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 1.0292 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.9375 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 2.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9375 1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7333 3.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3125 2.3958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1917 1.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 -1.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -0.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -1.7167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1500 -2.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -3.5458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7333 -3.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7333 -2.1750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.5250 -3.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 -4.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 -1.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5250 3.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3167 0.5708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1083 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 2.1708 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 1 0 0 0 27 30 1 6 0 0 0 17 31 1 0 0 0 0 13 32 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 2 10 1 34 -1 M END > CFN92050 > Malvidin-3-O-arabinoside chloride > 28500-04-1 > 98% > C22H23ClO11 > 498.9 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Malvidin-3-O-arabinoside-chloride-CFN92050.html $$$$ -ISIS- 10201511232D 91 99 0 0 0 0 0 0 0 0999 V2000 2.4167 -8.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4167 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -9.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6750 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -8.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3042 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -7.6083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9333 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -7.6083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2542 -8.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -7.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4792 -6.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5625 -6.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7917 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6792 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4083 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5625 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1792 -6.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6958 -7.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3958 -6.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9083 -7.3667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6125 -7.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7250 -8.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2167 -5.7917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 -5.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4750 -5.0667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -4.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2167 -5.0667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1000 -6.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1000 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7292 -5.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1625 -9.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1625 -8.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0958 -8.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -9.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -8.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -10.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -3.9792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2125 -3.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -2.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -2.5208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9500 -2.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9500 -3.6167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3542 -6.1542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3500 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.9792 -7.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.6125 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6125 -6.1542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.9792 -5.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -2.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3208 -2.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9792 -7.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -5.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -1.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -1.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8708 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3542 -7.9708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9833 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6125 -7.2458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6125 -7.9708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9833 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2375 -8.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9833 -6.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2375 -6.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9833 -9.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6125 -5.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 1 6 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 21 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 59 45 1 1 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 59 1 0 0 0 0 65 47 1 6 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 67 68 1 0 0 0 0 68 69 1 0 0 0 0 69 70 1 0 0 0 0 70 65 1 0 0 0 0 61 71 1 1 0 0 0 63 72 1 1 0 0 0 66 73 1 1 0 0 0 68 74 1 1 0 0 0 67 75 1 6 0 0 0 69 76 1 6 0 0 0 62 77 1 6 0 0 0 64 78 1 6 0 0 0 71 79 1 0 0 0 0 76 80 1 0 0 0 0 81 56 1 1 0 0 0 81 82 1 0 0 0 0 82 83 1 0 0 0 0 83 84 1 0 0 0 0 84 85 1 0 0 0 0 85 86 1 0 0 0 0 86 81 1 0 0 0 0 85 87 1 1 0 0 0 83 88 1 1 0 0 0 84 89 1 6 0 0 0 86 90 1 6 0 0 0 88 91 1 0 0 0 0 M END > CFN92065 > Iso-mogroside V > 1126032-65-2 > 98% > C60H102O29 > 1287.5 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Iso-mogroside-V-CFN92065.html $$$$ -ISIS- 10201511232D 21 22 0 0 0 0 0 0 0 0999 V2000 -3.7375 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7375 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 0.8708 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.2208 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0125 2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 2.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5292 0.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -1.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 2.0167 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 8 20 1 0 0 0 0 M CHG 2 10 1 21 -1 M END > CFN92132 > Pelargonidin chloride > 134-04-3 > 98% > C15H11O5Cl > 306.7 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Pelargonidin-chloride-CFN92132.html $$$$ -ISIS- 10201511232D 42 45 0 0 0 0 0 0 0 0999 V2000 -3.5833 -17.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5833 -18.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7917 -19.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9958 -18.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9958 -17.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7917 -17.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2042 -19.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -18.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -17.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2042 -17.2542 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.3750 -17.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1708 -17.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9625 -17.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9625 -16.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1708 -15.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -16.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -15.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3708 -17.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7917 -19.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3792 -19.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3792 -20.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4125 -20.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -21.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3792 -21.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1708 -21.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1708 -20.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9625 -21.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3792 -22.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9625 -20.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2042 -21.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9958 -21.3708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7875 -21.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5833 -21.3708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3750 -21.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3750 -22.7417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5833 -23.2000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7875 -22.7417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1667 -21.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5833 -24.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9958 -23.2000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1667 -23.2000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3167 -16.1083 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 8 20 1 0 0 0 0 21 20 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 25 27 1 1 0 0 0 24 28 1 6 0 0 0 26 29 1 6 0 0 0 23 30 1 1 0 0 0 30 31 1 0 0 0 0 32 31 1 1 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 32 1 0 0 0 0 34 38 1 6 0 0 0 36 39 1 6 0 0 0 37 40 1 6 0 0 0 35 41 1 1 0 0 0 M CHG 2 10 1 42 -1 M END > CFN92133 > Pelargonidin-3-O-rutinosde chloride > 33978-17-5 > 98% > C27H31O14Cl > 615.0 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Pelargonidin-3-O-rutinosde-chloride-CFN92133.html $$$$ -ISIS- 10201511232D 32 34 0 0 0 0 0 0 0 0999 V2000 7.7625 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -8.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -8.0958 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.7208 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -6.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7208 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -6.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -8.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -10.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -9.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -10.8417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9292 -11.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7250 -12.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5167 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5167 -11.3000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3042 -12.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -13.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -10.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -12.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -13.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -6.9542 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 8 20 1 0 0 0 0 21 20 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 25 27 1 1 0 0 0 24 28 1 6 0 0 0 26 29 1 6 0 0 0 23 30 1 1 0 0 0 30 31 1 0 0 0 0 M CHG 2 10 1 32 -1 M END > CFN92134 > Pelargonidin-3-O-glucoside chloride > 18466-51-8 > 98% > C21H21O10Cl > 468.8 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Pelargonidin-3-O-glucoside-chloride-CFN92134.html $$$$ -ISIS- 10201511232D 43 46 0 0 0 0 0 0 0 0999 V2000 -3.5833 -17.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5833 -18.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7917 -19.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9958 -18.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9958 -17.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7917 -17.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2042 -19.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -18.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -17.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2042 -17.2542 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.3750 -17.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1708 -17.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9625 -17.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9625 -16.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1708 -15.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -16.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1708 -14.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -15.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3708 -17.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7917 -19.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3792 -19.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3792 -20.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4125 -20.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -21.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3792 -21.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1708 -21.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1708 -20.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9625 -21.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3792 -22.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9625 -20.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2042 -21.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9958 -21.3708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7875 -21.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5833 -21.3708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3750 -21.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3750 -22.7417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5833 -23.2000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7875 -22.7417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1667 -21.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5833 -24.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9958 -23.2000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1667 -23.2000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3167 -16.1083 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 6 0 0 0 27 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 33 32 1 1 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 33 1 0 0 0 0 35 39 1 6 0 0 0 37 40 1 6 0 0 0 38 41 1 6 0 0 0 36 42 1 1 0 0 0 M CHG 2 10 1 43 -1 M END > CFN92135 > Cyanidin-3-O-rutinoside chloride > 18719-76-1 > 98% > C27H31O15Cl > 630.98 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Cyanidin-3-O-rutinoside-chloride-CFN92135.html $$$$ -ISIS- 10201511232D 44 47 0 0 0 0 0 0 0 0999 V2000 -3.1458 -17.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1458 -18.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3542 -19.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5583 -18.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5583 -17.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3542 -17.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7667 -19.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -18.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -17.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7667 -17.2833 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 0.8125 -17.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6083 -17.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -17.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -16.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6083 -15.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8125 -16.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6083 -15.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1875 -15.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9333 -17.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3542 -20.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -19.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -20.0292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0250 -20.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -21.4000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8167 -21.8583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6083 -21.4000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6083 -20.4875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4000 -21.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -22.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -20.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1917 -17.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7667 -21.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5583 -21.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -21.8583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1458 -21.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9375 -21.8583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.9375 -22.7750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1458 -23.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3500 -22.7750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.7292 -21.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1458 -24.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5583 -23.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7292 -23.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8792 -16.1417 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 6 0 0 0 27 30 1 6 0 0 0 13 31 1 0 0 0 0 24 32 1 1 0 0 0 32 33 1 0 0 0 0 34 33 1 1 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 34 1 0 0 0 0 36 40 1 6 0 0 0 38 41 1 6 0 0 0 39 42 1 6 0 0 0 37 43 1 1 0 0 0 M CHG 2 10 1 44 -1 M END > CFN92136 > Delphinidin-3-O-rutinoside chloride > 15674-58-5 > 98% > C27H31O16Cl > 645.0 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Delphinidin-3-O-rutinoside-chloride-CFN92136.html $$$$ -ISIS- 10201511232D 45 48 0 0 0 0 0 0 0 0999 V2000 0.0125 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0125 -3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -3.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5958 -3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5958 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -3.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -1.6917 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 3.9708 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7625 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5542 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5542 -0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7625 -0.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9708 -0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7625 0.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3458 -0.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7792 -1.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -4.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -3.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -4.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1792 -4.8917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -5.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9750 -6.2667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7667 -5.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7667 -4.8917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5542 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -7.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5542 -4.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3458 -2.1500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -6.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -7.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0125 -4.8917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7792 -4.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -4.8917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5750 -5.8042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7792 -6.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0125 -5.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7792 -7.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3667 -4.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3667 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1583 -4.8917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -0.5458 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 6 0 0 0 27 30 1 6 0 0 0 13 31 1 0 0 0 0 24 32 1 1 0 0 0 32 33 1 0 0 0 0 34 20 1 1 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 34 1 0 0 0 0 38 40 1 1 0 0 0 36 41 1 1 0 0 0 39 42 1 6 0 0 0 37 43 1 6 0 0 0 41 44 1 0 0 0 0 M CHG 2 10 1 45 -1 M END > CFN92137 > Delphinidin-3,5-O-diglucoside chloride > 17670-06-3 > 98% > C27H31O17Cl > 663.0 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Delphinidin-3-5-O-diglucoside-chloride-CFN92137.html $$$$ -ISIS- 10201511232D 44 47 0 0 0 0 0 0 0 0999 V2000 0.0125 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0125 -3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -3.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5958 -3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5958 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -3.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -1.6917 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 3.9708 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7625 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5542 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5542 -0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7625 -0.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9708 -0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7625 0.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3458 -0.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7792 -1.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -4.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -3.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -4.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1792 -4.8917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -5.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9750 -6.2667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7667 -5.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7667 -4.8917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5542 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -7.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5542 -4.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -6.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -7.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0125 -4.8917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7792 -4.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -4.8917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5750 -5.8042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7792 -6.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0125 -5.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7792 -7.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3667 -4.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3667 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1583 -4.8917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -0.5458 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 6 0 0 0 27 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 33 20 1 1 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 33 1 0 0 0 0 37 39 1 1 0 0 0 35 40 1 1 0 0 0 38 41 1 6 0 0 0 36 42 1 6 0 0 0 40 43 1 0 0 0 0 M CHG 2 10 1 44 -1 M END > CFN92138 > Cyanidin-3,5-O-diglucoside chloride > 2611-67-8 > 98% > C27H31O16Cl > 647.0 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Cyanidin-3-5-O-diglucoside-chloride-CFN92138.html $$$$ -ISIS- 10201511232D 43 46 0 0 0 0 0 0 0 0999 V2000 0.0125 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0125 -3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -3.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5958 -3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5958 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -3.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -1.6917 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 3.9708 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7625 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5542 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5542 -0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7625 -0.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9708 -0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3458 -0.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7792 -1.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -4.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -3.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -4.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1792 -4.8917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -5.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9750 -6.2667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7667 -5.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7667 -4.8917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5542 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -7.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5542 -4.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -6.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -7.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0125 -4.8917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7792 -4.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -4.8917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5750 -5.8042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7792 -6.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0125 -5.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7792 -7.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3667 -4.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3667 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1583 -4.8917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -0.5458 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 8 20 1 0 0 0 0 21 20 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 25 27 1 1 0 0 0 24 28 1 6 0 0 0 26 29 1 6 0 0 0 23 30 1 1 0 0 0 30 31 1 0 0 0 0 32 19 1 1 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 32 1 0 0 0 0 36 38 1 1 0 0 0 34 39 1 1 0 0 0 37 40 1 6 0 0 0 35 41 1 6 0 0 0 39 42 1 0 0 0 0 M CHG 2 10 1 43 -1 M END > CFN92170 > Pelargonidin-3,5-O-diglucoside chloride > 17334-58-6 > 98% > C27H31O15Cl > 631.0 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Pelargonidin-3-5-O-diglucoside-chloride-CFN92170.html $$$$ -ISIS- 10201511232D 43 46 0 0 0 0 0 0 0 0999 V2000 6.2917 -18.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -19.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0833 -20.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -19.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -18.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0833 -18.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6708 -20.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4625 -19.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4625 -18.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6708 -18.3458 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 10.2500 -18.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0458 -18.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8375 -18.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8375 -17.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0458 -16.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2500 -17.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0458 -16.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6250 -16.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -18.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0833 -21.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2542 -20.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2542 -21.0917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4625 -21.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4625 -22.4625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2542 -22.9208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0458 -22.4625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.0458 -21.5500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.8375 -22.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2542 -23.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8375 -21.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6292 -18.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6708 -22.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -22.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6292 -21.5500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.6292 -22.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4208 -22.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2125 -22.4667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.2125 -21.5500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4208 -21.0917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4208 -20.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0042 -21.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0042 -22.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5583 -17.2042 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 6 0 0 0 27 30 1 6 0 0 0 13 31 1 0 0 0 0 24 32 1 1 0 0 0 32 33 1 0 0 0 0 34 30 1 1 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 34 1 0 0 0 0 39 40 1 6 0 0 0 38 41 1 1 0 0 0 37 42 1 6 0 0 0 M CHG 2 10 1 43 -1 M END > CFN92171 > Delphinidin-3-sambubioside chloride > 53158-73-9 > 98% > C26H29O16Cl > 633.0 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Delphinidin-3-sambubioside-chloride-CFN92171.html $$$$ -ISIS- 10201511232D 42 45 0 0 0 0 0 0 0 0999 V2000 6.2917 -18.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -19.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0833 -20.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -19.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -18.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0833 -18.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6708 -20.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4625 -19.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4625 -18.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6708 -18.3458 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 10.2500 -18.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0458 -18.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8375 -18.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8375 -17.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0458 -16.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2500 -17.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0458 -16.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6250 -16.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -18.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0833 -21.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2542 -20.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2542 -21.0917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4625 -21.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4625 -22.4625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2542 -22.9208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0458 -22.4625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.0458 -21.5500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.8375 -22.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2542 -23.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8375 -21.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6708 -22.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -22.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6292 -21.5500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.6292 -22.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4208 -22.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2125 -22.4667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.2125 -21.5500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4208 -21.0917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4208 -20.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0042 -21.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0042 -22.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5583 -17.2042 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 6 0 0 0 27 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 33 30 1 1 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 33 1 0 0 0 0 38 39 1 6 0 0 0 37 40 1 1 0 0 0 36 41 1 6 0 0 0 M CHG 2 10 1 42 -1 M END > CFN92173 > Cyanidin-3-O-sambubioside chloride > 33012-73-6 > 98% > C26H29ClO15 > 617.0 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Cyanidin-3-O-sambubioside-chloride-CFN92173.html $$$$ -ISIS- 10201511232D 80 87 0 0 0 0 0 0 0 0999 V2000 2.4167 -8.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4167 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -9.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6750 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -8.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3042 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -7.6083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9333 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -7.6083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2542 -8.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -7.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4792 -6.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5625 -6.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7917 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6792 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4083 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5625 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1792 -6.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6958 -7.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3958 -6.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9083 -7.3667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6125 -7.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7250 -8.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2167 -5.7917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 -5.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4750 -5.0667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -4.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2167 -5.0667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1000 -6.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1000 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7292 -5.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1625 -9.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1625 -8.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0958 -8.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -9.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -8.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -10.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -6.5208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5333 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -5.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0958 -5.0708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7250 -5.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7250 -6.1583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1625 -5.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3542 -5.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -4.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3542 -6.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1625 -4.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3542 -6.1542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3500 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.9792 -7.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.6125 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6125 -6.1542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.9792 -5.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9792 -7.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -5.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8708 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 1 6 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 21 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 59 58 1 1 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 59 1 0 0 0 0 61 65 1 1 0 0 0 63 66 1 1 0 0 0 62 67 1 6 0 0 0 64 68 1 6 0 0 0 65 69 1 0 0 0 0 70 47 1 6 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 70 1 0 0 0 0 71 76 1 1 0 0 0 73 77 1 1 0 0 0 72 78 1 6 0 0 0 74 79 1 6 0 0 0 79 80 1 0 0 0 0 M END > CFN92188 > Mogroside IVa > 88901-41-1 > 98% > C54H92O24 > 1125.3 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Mogroside-IVa-CFN92188.html $$$$ -ISIS- 10201511232D 80 87 0 0 0 0 0 0 0 0999 V2000 2.4167 -8.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4167 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -9.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6750 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -8.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3042 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -7.6083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9333 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -7.6083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2542 -8.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -7.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4792 -6.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5625 -6.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7917 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6792 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4083 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5625 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1792 -6.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6958 -7.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3958 -6.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9083 -7.3667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6125 -7.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7250 -8.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2167 -5.7917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 -5.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4750 -5.0667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -4.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2167 -5.0667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1000 -6.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1000 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7292 -5.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1625 -9.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1625 -8.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0958 -8.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -9.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -8.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -10.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -6.5208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5333 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -5.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0958 -5.0708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7250 -5.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7250 -6.1583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1625 -5.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3542 -5.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -4.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3542 -6.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1625 -4.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -3.9792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2125 -3.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -2.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -2.5208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9500 -2.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9500 -3.6167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8417 -2.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3208 -2.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -1.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -1.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 1 6 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 21 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 59 58 1 1 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 59 1 0 0 0 0 61 65 1 1 0 0 0 63 66 1 1 0 0 0 62 67 1 6 0 0 0 64 68 1 6 0 0 0 65 69 1 0 0 0 0 70 45 1 1 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 70 1 0 0 0 0 72 76 1 1 0 0 0 74 77 1 1 0 0 0 73 78 1 6 0 0 0 75 79 1 6 0 0 0 76 80 1 0 0 0 0 M END > CFN92189 > Mogroside IVe > 88915-64-4 > 98% > C54H92O24 > 1125.3 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Mogroside-IVe-CFN92189.html $$$$ -ISIS- 10201511232D 69 75 0 0 0 0 0 0 0 0999 V2000 2.4167 -8.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4167 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -9.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6750 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0500 -8.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3042 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5625 -7.6083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9333 -7.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -7.6083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2542 -8.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -7.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4792 -6.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5625 -6.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7917 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6792 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4083 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5625 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1792 -6.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6958 -7.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3958 -6.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9083 -7.3667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6125 -7.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7250 -8.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 -7.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2167 -5.7917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -6.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 -5.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4750 -5.0667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8417 -4.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2167 -5.0667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1000 -6.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8417 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1000 -4.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7292 -5.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1625 -9.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1625 -8.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -8.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0958 -8.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -9.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5333 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -9.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -8.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -10.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3542 -6.1542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3500 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.9792 -7.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.6125 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6125 -6.1542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.9792 -5.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -7.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9792 -7.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -5.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8708 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 1 6 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 21 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 59 47 1 6 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 59 1 0 0 0 0 60 65 1 1 0 0 0 62 66 1 1 0 0 0 61 67 1 6 0 0 0 63 68 1 6 0 0 0 68 69 1 0 0 0 0 M END > CFN92190 > Mogroside III > 130567-83-8 > 98% > C48H82O19 > 963.2 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Mogroside-III-CFN92190.html $$$$ -ISIS- 10201511232D 58 63 0 0 0 0 0 0 0 0999 V2000 4.2083 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2083 -8.1917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8917 -8.5875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5750 -8.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -7.4042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8917 -7.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -8.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9375 -8.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9375 -7.4042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2542 -7.0125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6167 -7.0125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6167 -6.2250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9375 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -6.2250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3667 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8292 -6.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3667 -5.9792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6083 -5.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6167 -5.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -7.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5292 -8.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4958 -9.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2833 -9.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -6.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -5.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6167 -7.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -4.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3708 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9292 -5.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6875 -5.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.2458 -5.9625 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.0042 -5.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0417 -6.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8042 -6.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8917 -4.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9375 -6.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5750 -4.2542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2542 -4.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9375 -4.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.9375 -3.4667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2542 -3.0708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.5750 -3.4667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6167 -4.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2542 -2.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8917 -3.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6167 -3.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3000 -4.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -8.1917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8500 -7.4042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1667 -7.0125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4875 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4875 -8.1917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1667 -8.5833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1667 -6.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -8.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -7.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1667 -9.3708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4875 -5.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 1 6 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 21 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 M END > CFN92191 > Mogroside IIe > 88901-38-6 > 98% > C42H72O14 > 801.0 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Mogroside-Iie-CFN92191.html $$$$ -ISIS- 10201511232D 69 75 0 0 0 0 0 0 0 0999 V2000 -0.4458 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4458 -8.1625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2333 -8.5542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9167 -8.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9167 -7.3750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2333 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2792 -8.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2792 -7.3750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6000 -6.9792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9625 -6.9792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9625 -6.1917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2792 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7125 -7.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -6.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7125 -5.9500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9542 -5.2042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9625 -5.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1583 -9.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6292 -9.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9167 -6.5875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9208 -5.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9625 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3958 -4.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7167 -5.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2708 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0333 -5.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5917 -5.9292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3458 -5.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3875 -6.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1458 -6.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2375 -4.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2792 -6.5875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9167 -4.2208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6000 -4.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2833 -4.2208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2833 -3.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6000 -3.0417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9167 -3.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9625 -4.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 -2.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2375 -3.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9625 -3.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6417 -4.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8083 -8.1625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8083 -7.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4875 -6.9792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1708 -7.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1708 -8.1625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4875 -8.5542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4875 -6.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 -6.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4875 -9.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1708 -5.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 -4.6125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.3250 -5.4000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.0042 -5.7958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.6875 -5.4000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6875 -4.6125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0042 -4.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6417 -5.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3667 -5.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0042 -6.5792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3667 -4.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0500 -4.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 2 0 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 21 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 59 47 1 6 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 59 1 0 0 0 0 60 65 1 1 0 0 0 62 66 1 1 0 0 0 61 67 1 6 0 0 0 63 68 1 6 0 0 0 68 69 1 0 0 0 0 M END > CFN92192 > 11-Oxomogroside III > 952481-53-7 > 98% > C48H80O19 > 961.2 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/11-Oxomogroside-III-CFN92192.html $$$$ -ISIS- 10201511232D 69 75 0 0 0 0 0 0 0 0999 V2000 1.4750 -7.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -8.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1292 -8.9375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7792 -8.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -7.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1292 -7.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -8.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -8.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -7.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4292 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7292 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7292 -6.6833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0792 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -6.6833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4417 -7.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -7.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -6.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6750 -5.7375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7292 -5.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8292 -8.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -9.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -9.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -7.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -6.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -5.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -5.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6583 -5.9000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1875 -6.4333 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9125 -6.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -7.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7208 -6.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -5.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -7.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5042 -4.8042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1500 -5.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8042 -4.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8042 -4.0542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1500 -3.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5042 -4.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4500 -5.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -2.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1042 -4.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -2.9292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5000 -2.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 -1.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8500 -1.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1958 -1.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1958 -2.5542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7500 -5.1792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7458 -5.9333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3958 -6.3125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.0500 -5.9333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.0500 -5.1792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.3958 -4.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -1.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5458 -1.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0958 -6.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7000 -6.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3958 -7.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7000 -4.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -0.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -2.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -0.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3500 -5.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 1 6 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 45 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 54 47 1 6 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 54 1 0 0 0 0 50 60 1 1 0 0 0 52 61 1 1 0 0 0 55 62 1 1 0 0 0 57 63 1 1 0 0 0 56 64 1 6 0 0 0 58 65 1 6 0 0 0 51 66 1 6 0 0 0 53 67 1 6 0 0 0 60 68 1 0 0 0 0 65 69 1 0 0 0 0 M END > CFN92193 > Mogroside III-A1 > 88901-42-2 > 98% > C48H82O19 > 963.2 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Mogroside-III-A1-CFN92193.html $$$$ -ISIS- 10201511232D 58 63 0 0 0 0 0 0 0 0999 V2000 1.4750 -7.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -8.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1292 -8.9375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7792 -8.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -7.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1292 -7.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -8.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -8.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -7.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4292 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7292 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7292 -6.6833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0792 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -6.6833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4417 -7.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -7.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -6.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6750 -5.7375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7292 -5.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8292 -8.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -9.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -9.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -7.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -6.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -5.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -5.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6583 -5.9000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1875 -6.4333 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9125 -6.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -7.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7208 -6.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -5.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -7.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1792 -8.5583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1792 -7.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1208 -7.8083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1208 -8.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4708 -8.9333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4708 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7708 -8.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7708 -7.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -9.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -6.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -5.5583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4708 -5.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -4.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1208 -4.0583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7708 -4.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7708 -5.1833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1792 -4.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4208 -4.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -3.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4208 -5.5583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1792 -3.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 1 6 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 21 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 40 45 1 6 0 0 0 42 46 1 6 0 0 0 43 47 1 0 0 0 0 48 47 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 M END > CFN92203 > Mogroside II-A2 > 88901-45-5 > 98% > C42H72O14 > 801.0 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Mogroside-II-A2-CFN92203.html $$$$ -ISIS- 10201511232D 58 63 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7167 -10.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4958 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7167 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0583 -8.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -11.0833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3750 -11.5333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3750 -12.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -12.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9375 -12.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9375 -11.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -13.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -12.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 20 36 1 1 0 0 0 15 37 1 6 0 0 0 7 38 1 6 0 0 0 39 38 1 6 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 39 1 0 0 0 0 43 45 1 6 0 0 0 41 46 1 6 0 0 0 40 47 1 1 0 0 0 42 48 1 1 0 0 0 45 49 1 0 0 0 0 50 47 1 6 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 50 1 0 0 0 0 51 56 1 1 0 0 0 53 57 1 1 0 0 0 52 58 1 6 0 0 0 M END > CFN92364 > Notoginsenoside R2 > 80418-25-3 > 98% > C41H70O13 > 771.0 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Notoginsenoside-R2-CFN92364.html $$$$ -ISIS- 10201511232D 22 24 0 0 0 0 0 0 0 0999 V2000 3.9917 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9917 -5.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -6.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6292 -5.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6292 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -4.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -6.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2667 -5.7375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2667 -4.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4458 -4.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0833 -4.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9000 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7208 -4.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7208 -3.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9000 -2.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0833 -3.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -7.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -7.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -4.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5375 -2.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0833 -6.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5375 -4.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 1 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 7 17 2 0 0 0 0 3 18 1 0 0 0 0 1 19 1 0 0 0 0 14 20 1 0 0 0 0 8 21 1 6 0 0 0 13 22 1 0 0 0 0 M END > CFN92413 > (-)-Dihydroquercetin > 111003-33-9 > 98% > C15H12O7 > 304.3 > Cryst. > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Dihydroquercetin-CFN92413.html $$$$ -ISIS- 10201511232D 48 52 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7167 -10.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4958 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7167 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0583 -8.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 2 0 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 15 36 1 6 0 0 0 7 37 1 6 0 0 0 38 37 1 6 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 38 1 0 0 0 0 42 44 1 6 0 0 0 40 45 1 6 0 0 0 39 46 1 1 0 0 0 41 47 1 1 0 0 0 44 48 1 0 0 0 0 M END > CFN92593 > Ginsenoside Rk3 > 364779-15-7 > 98% > C36H60O8 > 620.9 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rk3-CFN92593.html $$$$ -ISIS- 10201511232D 48 52 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7167 -10.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4958 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7167 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0583 -8.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0583 -1.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -2.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -2.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6167 -1.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 2 0 0 0 0 11 26 1 6 0 0 0 20 15 1 0 0 0 0 9 27 1 1 0 0 0 10 28 1 6 0 0 0 2 29 1 1 0 0 0 13 30 1 1 0 0 0 15 31 1 6 0 0 0 7 32 1 6 0 0 0 33 32 1 6 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 33 1 0 0 0 0 37 39 1 6 0 0 0 35 40 1 6 0 0 0 34 41 1 1 0 0 0 36 42 1 1 0 0 0 39 43 1 0 0 0 0 25 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 2 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M END > CFN92594 > Ginsenoside Rh4 > 174721-08-5 > 98% > C36H60O8 > 620.9 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rh4-CFN92594.html $$$$ -ISIS- 10201511232D 57 62 0 0 0 0 0 0 0 0999 V2000 3.9000 -7.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6708 -9.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4417 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4417 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6708 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -8.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2167 -7.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7583 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7583 -6.5625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9875 -6.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2167 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -6.1167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3000 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -5.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -5.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -9.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2292 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0708 -5.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -8.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -5.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -6.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4250 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -8.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -5.2250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -8.7875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3583 -7.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8167 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8167 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -9.2333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -10.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -7.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -6.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -10.5667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0458 -10.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -10.5667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7250 -11.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0458 -11.9042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8167 -11.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4958 -10.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -12.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4958 -11.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -11.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -10.5667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 0 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 2 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 15 20 1 1 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 47 44 1 1 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 47 1 0 0 0 0 49 53 1 1 0 0 0 51 54 1 1 0 0 0 50 55 1 6 0 0 0 52 56 1 6 0 0 0 53 57 1 0 0 0 0 M END > CFN92643 > Ginsenoside Rg5 > 186763-78-0 > 98% > C42H70O12 > 767.0 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rg5-CFN92643.html $$$$ -ISIS- 10201511232D 58 63 0 0 0 0 0 0 0 0999 V2000 3.9000 -7.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6708 -9.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4417 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4417 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6708 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -8.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2167 -7.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7583 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7583 -6.5625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9875 -6.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2167 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -6.1167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3000 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -5.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -5.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -9.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2292 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0708 -5.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -8.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -5.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -6.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4250 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -8.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -5.2250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -8.7875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3583 -7.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8167 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8167 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -9.2333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -10.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -7.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -6.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -5.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -10.5667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0458 -10.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -10.5667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7250 -11.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0458 -11.9042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8167 -11.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4958 -10.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -12.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4958 -11.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -11.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -10.5667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 2 0 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 15 47 1 6 0 0 0 48 44 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 M END > CFN92644 > Ginsenoside Rk2 > 494753-69-4 > 98% > C42H70O12 > 767.0 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rk1-CFN92644.html $$$$ -ISIS- 10201511232D 62 67 0 0 0 0 0 0 0 0999 V2000 4.3917 -6.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3917 -7.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1625 -7.4708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9333 -7.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9333 -6.1333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1625 -5.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -7.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -7.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -6.1333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7083 -5.6875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2500 -5.6875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2500 -4.8000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4792 -4.3542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7083 -4.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0208 -4.3542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7917 -4.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7917 -5.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2500 -3.9083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -5.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0208 -3.4625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2500 -3.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6083 -8.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -7.9125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7208 -8.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7917 -3.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5625 -3.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2500 -6.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3750 -3.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1458 -3.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -5.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1458 -4.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9167 -3.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -6.5792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6208 -7.4708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -3.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -7.0250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8500 -6.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0792 -5.6875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3083 -6.1333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3083 -7.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0792 -7.4708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0792 -4.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5375 -7.4708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0792 -8.3583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5375 -5.6875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3083 -4.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0208 -2.5708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7917 -3.9083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3083 -8.8042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5375 -8.3583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2333 -8.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2333 -9.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5375 -10.1417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3083 -9.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0042 -8.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5375 -11.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0042 -10.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0792 -10.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -8.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5458 -8.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5458 -7.4708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3167 -8.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 20 47 1 1 0 0 0 15 48 1 6 0 0 0 49 44 1 1 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 49 1 0 0 0 0 51 55 1 1 0 0 0 53 56 1 1 0 0 0 52 57 1 6 0 0 0 54 58 1 6 0 0 0 55 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 2 0 0 0 0 60 62 1 0 0 0 0 M END > CFN92813 > Ginsenoside Rs3 > 194861-70-6 > 98% > C44H74O14 > 827.1 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rs3-CFN92813.html $$$$ -ISIS- 10201511232D 46 50 0 0 0 0 0 0 0 0999 V2000 5.2292 -6.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2292 -7.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0167 -8.1500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8042 -7.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8042 -6.7833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0167 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5958 -8.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -7.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -6.7833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5958 -6.3292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1667 -6.3292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1667 -5.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3792 -4.9667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5958 -5.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9542 -4.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7417 -5.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7417 -6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1667 -4.5125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8042 -5.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9542 -4.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1667 -3.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4708 -8.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8042 -8.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5667 -8.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7417 -3.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5292 -4.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1667 -7.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3583 -3.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1458 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -5.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1458 -5.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9333 -3.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5958 -7.2375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -8.1500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -4.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6542 -7.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6542 -6.7833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8708 -6.3292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0833 -6.7833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0833 -7.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8708 -8.1500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8708 -5.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2958 -8.1500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8708 -9.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2958 -6.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0833 -4.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 2 0 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 15 20 1 1 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 M END > CFN92818 > Ginsenoside Rk1 > 364779-14-6 > 98% > C36H60O7 > 604.9 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rk2-CFN92818.html $$$$ -ISIS- 10201511232D 57 62 0 0 0 0 0 0 0 0999 V2000 1.6417 -13.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6417 -14.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4208 -14.8833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2000 -14.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2000 -13.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4208 -13.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -14.8833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7667 -14.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7667 -13.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9875 -13.0792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5458 -13.0792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5458 -12.1792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7667 -11.7292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9875 -12.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3292 -11.7292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1083 -12.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1083 -13.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5458 -11.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -12.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3292 -10.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5458 -10.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8708 -15.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -15.3333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -15.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1083 -10.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8875 -10.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5458 -13.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7125 -10.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4917 -10.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7667 -12.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4917 -11.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2750 -10.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -13.9792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8583 -14.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7667 -10.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1083 -11.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -15.7833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7667 -16.2333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7667 -17.1375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5500 -17.5875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3292 -17.1375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3292 -16.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5500 -15.7833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1083 -15.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 -18.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -17.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1083 -17.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -16.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -18.4875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2083 -18.9375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2083 -19.8417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9875 -20.2917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7708 -19.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7708 -18.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 -18.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -21.1917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 -20.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 2 0 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 15 36 1 6 0 0 0 7 37 1 6 0 0 0 38 37 1 6 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 38 1 0 0 0 0 42 44 1 6 0 0 0 40 45 1 6 0 0 0 39 46 1 1 0 0 0 41 47 1 1 0 0 0 44 48 1 0 0 0 0 49 46 1 6 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 49 1 0 0 0 0 50 55 1 1 0 0 0 52 56 1 1 0 0 0 51 57 1 6 0 0 0 M END > CFN92824 > Notoginsenoside T5 > 769932-34-5 > 98% > C41H68O12 > 753.0 > Powder > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Notoginsenoside-T5-CFN92824.html $$$$ -ISIS- 10201511232D 12 13 0 0 0 0 0 0 0 0999 V2000 4.6792 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6792 -7.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4875 -7.5833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3042 -7.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3042 -6.1833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4875 -5.7125 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4875 -8.5208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3042 -8.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6792 -8.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4875 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -8.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1167 -5.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 3 7 1 6 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 6 11 1 0 0 0 0 5 12 1 1 0 0 0 M END > CFN97032 > 2-Hydroxy-1,8-cineole > 60761-00-4 > 98% > C10H18O2 > 170.3 > Oil > Monoterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-Hydroxy-1-8-cineole-CFN97032.html $$$$ -ISIS- 10201511232D 28 33 0 0 0 0 0 0 0 0999 V2000 -0.2500 -8.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -9.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -10.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -9.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -8.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -8.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -8.3917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8458 -8.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6208 -8.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -7.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6208 -7.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0750 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6208 -6.6042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3958 -6.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9458 -6.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9458 -5.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -4.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -5.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1792 -7.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5167 -7.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -8.5625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -9.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -10.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7958 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3208 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7958 -4.9875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 7 10 1 0 0 0 0 9 11 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 11 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 14 15 1 6 0 0 0 7 5 1 6 0 0 0 10 21 1 6 0 0 0 11 22 1 6 0 0 0 1 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 2 1 0 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 18 1 0 0 0 0 M END > CFN97034 > Sesamin > 607-80-7 > 98% > C20H18O6 > 354.4 > Powder > Lignans > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sesamin-CFN97034.html $$$$ -ISIS- 10201511232D 39 43 0 0 0 0 0 0 0 0999 V2000 3.4625 -14.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -15.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2667 -15.9250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0750 -15.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0750 -14.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2667 -14.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -15.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -15.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -14.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -14.0625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -14.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -13.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -12.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -13.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3000 -14.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1083 -14.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1083 -13.1333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3000 -12.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -15.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -16.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -13.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -13.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -13.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -14.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -16.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -12.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -11.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1083 -11.2708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3000 -11.7333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1083 -10.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -11.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3000 -13.5958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -14.9958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -16.3917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7208 -13.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -14.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -15.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -14.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0458 -15.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 2 19 1 1 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 28 30 1 6 0 0 0 29 31 1 1 0 0 0 18 32 1 1 0 0 0 10 33 1 6 0 0 0 4 34 1 6 0 0 0 23 35 1 0 0 0 0 23 36 2 0 0 0 0 19 37 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 M END > CFN97219 > Acetylursolic acid > 7372-30-7 > 98% > C32H50O4 > 498.8 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Acetylursolic-acid-CFN97219.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.4625 -14.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -15.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2667 -15.9250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0750 -15.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0750 -14.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2667 -14.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -15.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -15.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -14.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -14.0625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -14.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -13.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -12.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -13.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3000 -14.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1083 -14.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1083 -13.1333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3000 -12.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -15.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -16.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -13.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -13.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -13.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -14.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -16.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -12.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -11.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1083 -11.2708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3000 -11.7333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1083 -10.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -11.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3000 -13.5958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -14.9958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -16.3917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7208 -13.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -14.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 2 19 1 1 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 28 30 1 6 0 0 0 29 31 1 1 0 0 0 18 32 1 1 0 0 0 10 33 1 6 0 0 0 4 34 1 6 0 0 0 23 35 1 0 0 0 0 23 36 2 0 0 0 0 M END > CFN97259 > Ursolic acid > 77-52-1 > 98% > C30H48O3 > 456.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ursolic-acid-CFN97259.html $$$$ -ISIS- 10201511232D 48 53 0 0 0 0 0 0 0 0999 V2000 2.9417 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -8.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7458 -8.7375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5417 -8.2750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5417 -7.3500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7458 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -8.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -8.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -7.3500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3458 -6.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9417 -6.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9417 -5.9625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1458 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -5.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7458 -5.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5500 -5.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9417 -5.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9417 -7.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7458 -4.5750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9417 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 -4.5750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7542 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2833 -9.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2083 -9.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1417 -8.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7542 -5.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -5.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -6.4250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -7.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5417 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -7.8125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5542 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3375 -8.2750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3417 -7.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5375 -6.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2625 -7.3458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2625 -8.2750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5375 -8.7375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0667 -8.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5375 -5.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0667 -6.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5417 -9.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2625 -5.4958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 11 19 1 6 0 0 0 15 20 1 0 0 0 0 20 21 1 6 0 0 0 22 20 1 0 0 0 0 23 22 1 0 0 0 0 24 23 2 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 25 27 1 0 0 0 0 3 28 1 1 0 0 0 3 29 1 6 0 0 0 2 30 1 1 0 0 0 25 31 1 0 0 0 0 15 32 1 6 0 0 0 9 33 1 1 0 0 0 4 34 1 1 0 0 0 10 35 1 1 0 0 0 35 34 1 0 0 0 0 5 36 1 6 0 0 0 31 37 1 0 0 0 0 38 30 1 1 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 38 1 0 0 0 0 42 44 1 6 0 0 0 40 45 1 1 0 0 0 41 46 1 6 0 0 0 43 47 1 6 0 0 0 45 48 1 0 0 0 0 M END > CFN97295 > Momordicoside G > 81371-54-2 > 98% > C37H60O8 > 632.9 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Momordicoside-G-CFN97295.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 2.9417 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -8.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7458 -8.7375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5417 -8.2750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5417 -7.3500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7458 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -8.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -8.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -7.3500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3458 -6.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9417 -6.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9417 -5.9625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1458 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -5.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7458 -5.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5500 -5.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9417 -5.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9417 -7.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7458 -4.5750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9417 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 -4.5750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7542 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2833 -9.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2083 -9.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1417 -8.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7542 -5.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -5.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -6.4250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -7.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5417 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -7.8125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5542 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 11 19 1 6 0 0 0 15 20 1 0 0 0 0 20 21 1 6 0 0 0 22 20 1 0 0 0 0 23 22 1 0 0 0 0 24 23 2 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 25 27 1 0 0 0 0 3 28 1 1 0 0 0 3 29 1 6 0 0 0 2 30 1 1 0 0 0 25 31 1 0 0 0 0 15 32 1 6 0 0 0 9 33 1 1 0 0 0 4 34 1 1 0 0 0 10 35 1 1 0 0 0 35 34 1 0 0 0 0 5 36 1 6 0 0 0 31 37 1 0 0 0 0 M END > CFN97299 > 5,19-Epoxy-25-methoxycucurbita-6,23-dien-3-ol > 81910-39-6 > 98% > C31H50O3 > 470.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/5-19-Epoxy-25-methoxycucurbita-6-23-dien-3-ol-CFN97299.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 2.9417 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -8.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7458 -8.7375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5417 -8.2750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5417 -7.3500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7458 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -8.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -8.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -7.3500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3458 -6.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9417 -6.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9417 -5.9625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1458 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -5.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7458 -5.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5500 -5.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9417 -5.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9417 -7.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7458 -4.5750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9417 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 -4.5750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7542 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2833 -9.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2083 -9.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1417 -8.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7542 -5.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -5.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -6.4250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -7.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5417 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -7.8125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 11 19 1 6 0 0 0 15 20 1 0 0 0 0 20 21 1 6 0 0 0 22 20 1 0 0 0 0 23 22 1 0 0 0 0 24 23 2 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 25 27 1 0 0 0 0 3 28 1 1 0 0 0 3 29 1 6 0 0 0 2 30 1 1 0 0 0 25 31 1 0 0 0 0 15 32 1 6 0 0 0 9 33 1 1 0 0 0 4 34 1 1 0 0 0 10 35 1 1 0 0 0 35 34 1 0 0 0 0 5 36 1 6 0 0 0 M END > CFN97300 > Momordicoside I aglycone > 81910-41-0 > 98% > C30H48O3 > 456.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Momordicoside-I-aglycone-CFN97300.html $$$$ -ISIS- 10201511232D 34 37 0 0 0 0 0 0 0 0999 V2000 -1.6750 -6.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -7.8000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8750 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0792 -7.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0792 -6.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8750 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7167 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5125 -7.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5125 -6.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7167 -6.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3125 -6.4208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3125 -5.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5125 -5.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7167 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1083 -5.0375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9042 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1083 -4.1167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3125 -3.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -3.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7042 -4.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -3.6583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -4.1167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0958 -3.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -5.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0792 -5.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -4.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4708 -8.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7167 -7.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -7.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -4.5792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5125 -5.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -2.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -2.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 18 19 1 6 0 0 0 20 18 1 0 0 0 0 21 20 2 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 23 25 1 0 0 0 0 5 26 1 1 0 0 0 12 27 1 1 0 0 0 2 28 1 1 0 0 0 10 29 1 6 0 0 0 11 30 1 6 0 0 0 18 15 1 0 0 0 0 15 31 1 6 0 0 0 9 32 1 1 0 0 0 22 33 1 1 0 0 0 33 34 1 0 0 0 0 M END > CFN97326 > Stigmasterol > 83-48-7 > 98% > C29H48O > 412.7 > Powder > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Stigmasterol-CFN97326.html $$$$ -ISIS- 10201511232D 34 37 0 0 0 0 0 0 0 0999 V2000 -1.6750 -6.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -7.8000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8750 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0792 -7.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0792 -6.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8750 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7167 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5125 -7.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5125 -6.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7167 -6.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3125 -6.4208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3125 -5.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5125 -5.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7167 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1083 -5.0375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9042 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1083 -4.1167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3125 -3.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -3.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7042 -4.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -3.6583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -4.1167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0958 -3.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -5.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0792 -5.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -4.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4708 -8.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7167 -7.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -7.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -4.5792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5125 -5.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -2.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -2.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 18 19 1 6 0 0 0 20 18 1 0 0 0 0 21 20 2 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 23 25 1 0 0 0 0 5 26 1 1 0 0 0 12 27 1 1 0 0 0 2 28 1 1 0 0 0 10 29 1 6 0 0 0 11 30 1 6 0 0 0 18 15 1 0 0 0 0 15 31 1 6 0 0 0 9 32 1 1 0 0 0 22 33 1 1 0 0 0 33 34 1 0 0 0 0 M END > CFN97326 > Stigmasterol > 83-48-7 > 98% > C29H48O > 412.7 > Powder > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Stigmasterol-CFN97326.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 0.9792 -6.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9792 -7.5917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7542 -8.0375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5292 -7.5917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5292 -6.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7542 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -8.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -7.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -6.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3042 -6.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8542 -6.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -4.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6292 -6.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4042 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4042 -5.3542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6292 -4.9042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2042 -8.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3083 -8.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5292 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1833 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8542 -7.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2042 -8.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1833 -4.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1833 -4.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4042 -3.5625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6292 -4.0125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5292 -8.4875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -7.1417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 -7.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3458 -8.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5708 -6.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4042 -2.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6292 -5.8000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8542 -3.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 2 19 1 1 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 4 30 1 6 0 0 0 10 31 1 6 0 0 0 32 19 1 0 0 0 0 33 32 1 0 0 0 0 32 34 2 0 0 0 0 28 35 1 6 0 0 0 18 36 1 1 0 0 0 29 37 1 1 0 0 0 M END > CFN97423 > alpha-Amyrin acetate > 863-76-3 > 98% > C32H52O2 > 468.8 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/alpha-Amyrin-acetate-CFN97423.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 2.5083 -6.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5083 -7.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.6167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5458 -7.3167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5458 -6.7167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0250 -6.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0667 -7.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5833 -7.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5833 -6.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0667 -6.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -6.4167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1042 -5.8167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5833 -5.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0667 -5.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 -5.5167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1458 -5.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -6.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -5.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5458 -6.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9875 -7.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 -4.9167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1042 -4.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -4.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6625 -4.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1833 -4.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7042 -4.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2208 -4.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7042 -5.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -8.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -8.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2208 -5.8167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1833 -5.8167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 2 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 2 20 2 0 0 0 0 11 21 1 6 0 0 0 15 22 1 1 0 0 0 22 23 1 6 0 0 0 24 22 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 27 26 2 0 0 0 0 28 27 1 0 0 0 0 27 29 1 0 0 0 0 3 30 1 1 0 0 0 3 31 1 6 0 0 0 29 32 1 0 0 0 0 29 33 2 0 0 0 0 M END > CFN97426 > Ganoderic acid SZ > 865543-37-9 > 98% > C30H44O3 > 452.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderic-acid-SZ-CFN97426.html $$$$ -ISIS- 10201511232D 38 41 0 0 0 0 0 0 0 0999 V2000 2.8917 -7.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8917 -8.2167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6792 -8.6708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4667 -8.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 -7.3042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6792 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2583 -8.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0458 -8.2167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0458 -7.3042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2583 -6.8500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8333 -6.8500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8333 -5.9375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0458 -5.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2583 -5.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6250 -5.4833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4125 -5.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4125 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8333 -5.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8333 -7.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6250 -4.5708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8333 -4.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4125 -4.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2000 -4.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9875 -4.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -4.5708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5667 -4.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -5.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 -9.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1333 -9.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -8.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5667 -5.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4125 -5.0292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0458 -6.3958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3542 -4.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2583 -7.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 -6.3958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8333 -8.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6250 -8.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 11 19 1 6 0 0 0 15 20 1 0 0 0 0 20 21 1 6 0 0 0 22 20 1 0 0 0 0 23 22 1 0 0 0 0 24 23 2 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 25 27 1 0 0 0 0 3 28 1 1 0 0 0 3 29 1 6 0 0 0 2 30 1 1 0 0 0 25 31 1 0 0 0 0 15 32 1 6 0 0 0 9 33 1 1 0 0 0 31 34 1 0 0 0 0 10 35 1 1 0 0 0 5 36 1 6 0 0 0 8 37 1 1 0 0 0 37 38 1 0 0 0 0 M END > CFN97478 > Karavilagenin A > 912329-03-4 > 98% > C32H54O3 > 486.8 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Karavilagenin-A-CFN97478.html $$$$ -ISIS- 10201511232D 14 15 0 0 0 0 0 0 0 0999 V2000 4.9917 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -5.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 M END > CFN97494 > Scopoletin > 92-61-5 > 98% > C10H8O4 > 192.2 > Cryst. > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Scopoletin-CFN97494.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 2.9417 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -8.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7458 -8.7375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5417 -8.2750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5417 -7.3500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7458 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -8.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -8.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -7.3500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3458 -6.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9417 -6.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9417 -5.9625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1458 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -5.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7458 -5.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5500 -5.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9417 -5.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9417 -7.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7458 -4.5750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9417 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 -4.5750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7542 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2833 -9.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2083 -9.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1417 -8.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7542 -5.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -5.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -6.4250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -7.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5417 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -7.8125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -5.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 11 19 1 6 0 0 0 15 20 1 0 0 0 0 20 21 1 6 0 0 0 22 20 1 0 0 0 0 23 22 1 0 0 0 0 24 23 2 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 25 27 1 0 0 0 0 3 28 1 1 0 0 0 3 29 1 6 0 0 0 2 30 1 1 0 0 0 25 31 1 0 0 0 0 15 32 1 6 0 0 0 9 33 1 1 0 0 0 4 34 1 1 0 0 0 10 35 1 1 0 0 0 35 34 1 0 0 0 0 5 36 1 6 0 0 0 35 37 2 0 0 0 0 M END > CFN97506 > Karavilagenin D > 934739-29-4 > 98% > C30H46O4 > 470.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Karavilagenin-D-CFN97506.html $$$$ -ISIS- 10201511232D 40 44 0 0 0 0 0 0 0 0999 V2000 2.9042 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9042 -8.2250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6958 -8.6833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4875 -8.2250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4875 -7.3083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6958 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2833 -8.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -8.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -7.3083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2833 -6.8500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8667 -6.8500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8667 -5.9333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0750 -5.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2833 -5.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6583 -5.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4542 -5.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4542 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8667 -5.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8667 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6583 -4.5625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8667 -4.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4542 -4.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2500 -4.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0375 -4.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8333 -4.5625 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6292 -4.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8333 -5.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2417 -9.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1542 -9.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1083 -8.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6292 -5.0208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4542 -5.0208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -6.3917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2833 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4875 -6.3917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6958 -7.7667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4167 -4.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5708 -6.3917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -5.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -4.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 11 19 1 6 0 0 0 15 20 1 0 0 0 0 20 21 1 6 0 0 0 22 20 1 0 0 0 0 23 22 1 0 0 0 0 24 23 2 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 25 27 1 0 0 0 0 3 28 1 1 0 0 0 3 29 1 6 0 0 0 2 30 1 1 0 0 0 25 31 1 0 0 0 0 15 32 1 6 0 0 0 9 33 1 1 0 0 0 4 34 1 1 0 0 0 10 35 1 1 0 0 0 35 34 1 0 0 0 0 5 36 1 6 0 0 0 31 37 1 0 0 0 0 35 38 1 0 0 0 0 35 39 1 0 0 0 0 39 40 1 0 0 0 0 M END > CFN97816 > 5,19-Epoxy-19R,25-dimethoxycucurbita-6,23-dien-3-ol > 85372-72-1 > 98% > C32H52O4 > 500.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/5-19-Epoxy-19-25--dimethoxycucurbita-6-23-dien-3-ol--CFN97816.html $$$$ -ISIS- 10201511232D 45 49 0 0 0 0 0 0 0 0999 V2000 5.1583 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -8.1625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8417 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -8.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -7.3708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8417 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2083 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -8.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -7.3708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2083 -6.9792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5708 -6.9792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5708 -6.1917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8917 -5.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2083 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5708 -5.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7917 -8.9500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1125 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 -8.9500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4292 -9.7375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1125 -10.1333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7917 -9.7375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1125 -10.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7458 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -10.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7458 -10.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0625 -8.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2083 -7.7667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5708 -7.7667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -6.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2542 -5.7958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.9375 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2542 -5.0083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5708 -4.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -4.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6208 -5.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3042 -4.6125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.9875 -5.0083 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.6708 -4.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9875 -5.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3042 -3.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9875 -3.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 5 15 1 1 0 0 0 12 16 1 1 0 0 0 2 17 1 1 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 18 1 0 0 0 0 18 17 1 1 0 0 0 22 24 1 1 0 0 0 20 25 1 1 0 0 0 23 26 1 6 0 0 0 21 27 1 6 0 0 0 25 28 1 0 0 0 0 10 29 1 6 0 0 0 11 30 1 6 0 0 0 9 31 1 1 0 0 0 12 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 11 34 1 0 0 0 0 32 35 1 0 0 0 0 35 36 1 6 0 0 0 32 37 1 6 0 0 0 38 35 1 0 0 0 0 39 38 2 0 0 0 0 40 39 1 0 0 0 0 41 40 1 0 0 0 0 42 41 1 0 0 0 0 41 43 1 0 0 0 0 40 44 1 1 0 0 0 44 45 1 0 0 0 0 M END > CFN98000 > Stigmasterol glucoside > 19716-26-8 > 98% > C35H58O6 > 574.8 > Powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Stigmasterol-glucoside-CFN98000.html $$$$ -ISIS- 10201511232D 16 17 0 0 0 0 0 0 0 0999 V2000 4.4292 -5.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -5.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 -6.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4667 -5.2708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9500 -4.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -6.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -5.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -5.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -4.9750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9500 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -6.7708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9875 -4.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4667 -4.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9125 -6.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -7.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 -6.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 4 5 1 0 0 0 0 5 1 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 4 1 0 0 0 0 3 10 1 0 0 0 0 6 11 1 0 0 0 0 10 11 1 0 0 0 0 9 12 1 1 0 0 0 9 13 1 6 0 0 0 4 13 1 1 0 0 0 2 14 1 0 0 0 0 11 15 1 1 0 0 0 11 16 1 6 0 0 0 M END > CFN98008 > Humulene epoxide II > 19888-34-7 > 98% > C15H24O > 220.4 > Oil > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Humulene-epoxide-II-CFN98008.html $$$$ -ISIS- 10201511232D 18 20 0 0 0 0 0 0 0 0999 V2000 2.7333 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7333 -3.8833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -2.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -3.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8625 -4.1667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4500 -4.4542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3417 -4.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7375 -3.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3417 -2.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 -2.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2458 -1.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 -5.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 -5.3667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2083 -5.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8083 -5.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -5.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4125 -6.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4958 -4.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 2 1 0 0 0 0 2 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 1 2 0 0 0 0 10 11 1 0 0 0 0 5 12 1 1 0 0 0 6 13 1 6 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 7 15 1 1 0 0 0 15 16 2 0 0 0 0 14 17 2 0 0 0 0 2 18 1 1 0 0 0 5 18 1 6 0 0 0 M END > CFN98034 > Parthenolide > 20554-84-1 > 98% > C15H20O3 > 248.3 > Powder > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Parthenolide-CFN98034.html $$$$ -ISIS- 10201511232D 56 63 0 0 0 0 0 0 0 0999 V2000 0.5750 -4.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -5.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0958 -5.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6125 -5.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6125 -4.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0958 -4.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1333 -5.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -5.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -4.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1333 -4.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1333 -3.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6125 -3.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0958 -3.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -4.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -3.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -3.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6125 -2.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1333 -6.1042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0542 -5.5042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0542 -4.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -3.4042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -4.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1208 -0.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1208 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6417 -1.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1583 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1583 -0.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6417 -0.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6042 -0.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6417 -0.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6042 -1.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5583 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5583 -7.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0792 -8.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5958 -7.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5958 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0792 -7.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0417 -7.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0417 -8.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0792 -8.8542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1958 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9042 -3.5125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9042 -4.1125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4208 -4.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9417 -4.1125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9417 -3.5125 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4208 -3.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4208 -5.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4583 -3.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3833 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3833 -4.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4583 -4.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8667 -3.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7583 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0583 -1.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3542 -7.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 6 1 0 0 0 0 9 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 11 2 0 0 0 0 12 17 2 0 0 0 0 7 18 2 0 0 0 0 2 19 1 0 0 0 0 1 20 1 0 0 0 0 15 21 1 0 0 0 0 14 22 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 23 1 0 0 0 0 23 29 1 0 0 0 0 28 30 1 0 0 0 0 24 31 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 37 32 1 0 0 0 0 32 38 1 0 0 0 0 33 39 1 0 0 0 0 34 40 1 0 0 0 0 36 41 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 42 1 0 0 0 0 44 48 1 1 0 0 0 46 49 1 0 0 0 0 42 50 1 1 0 0 0 43 51 1 6 0 0 0 45 52 1 6 0 0 0 50 53 1 0 0 0 0 26 54 1 0 0 0 0 54 55 2 0 0 0 0 54 53 1 0 0 0 0 41 56 2 0 0 0 0 41 51 1 0 0 0 0 25 16 1 0 0 0 0 3 37 1 0 0 0 0 M END > CFN98113 > Punicalin > 65995-64-4 > 98% > C34H22O22 > 782.52 > Powder > Phenols > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Punicalin-CFN98113.html $$$$ -ISIS- 10201511232D 40 41 0 0 0 0 0 0 0 0999 V2000 -3.8583 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8583 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1792 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1792 -5.8000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8167 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1375 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4542 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9042 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2667 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6292 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6708 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3917 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7542 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4333 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8167 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4542 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2667 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6708 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3917 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1167 -6.1917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7958 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7958 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1167 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4333 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7542 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7250 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7875 -5.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5708 -5.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5083 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 2 0 0 0 0 11 10 1 0 0 0 0 12 11 2 0 0 0 0 13 12 1 0 0 0 0 14 13 2 0 0 0 0 15 14 1 0 0 0 0 16 15 2 0 0 0 0 17 16 1 0 0 0 0 18 17 2 0 0 0 0 19 18 1 0 0 0 0 20 19 2 0 0 0 0 21 20 1 0 0 0 0 22 21 2 0 0 0 0 23 22 1 0 0 0 0 24 23 2 0 0 0 0 4 26 1 0 0 0 0 9 27 1 0 0 0 0 13 28 1 0 0 0 0 18 29 1 0 0 0 0 22 30 1 0 0 0 0 25 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 25 2 0 0 0 0 35 36 1 0 0 0 0 25 24 1 0 0 0 0 31 37 1 6 0 0 0 6 38 1 6 0 0 0 6 39 1 1 0 0 0 31 40 1 1 0 0 0 M END > CFN98117 > Beta-Carotene > 7235-40-7 > 98% > C40H56 > 536.88 > Powder > Miscellaneous > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Carotene-CFN98117.html $$$$ -ISIS- 10201511232D 40 41 0 0 0 0 0 0 0 0999 V2000 -3.8583 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8583 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1792 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1792 -5.8000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8167 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1375 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4542 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9042 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2667 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6292 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6708 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3917 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7542 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4333 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8167 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4542 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2667 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6708 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3917 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1167 -6.1917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7958 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7958 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1167 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4333 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7542 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7250 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7875 -5.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5708 -5.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5083 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 2 0 0 0 0 11 10 1 0 0 0 0 12 11 2 0 0 0 0 13 12 1 0 0 0 0 14 13 2 0 0 0 0 15 14 1 0 0 0 0 16 15 2 0 0 0 0 17 16 1 0 0 0 0 18 17 2 0 0 0 0 19 18 1 0 0 0 0 20 19 2 0 0 0 0 21 20 1 0 0 0 0 22 21 2 0 0 0 0 23 22 1 0 0 0 0 24 23 2 0 0 0 0 4 26 1 0 0 0 0 9 27 1 0 0 0 0 13 28 1 0 0 0 0 18 29 1 0 0 0 0 22 30 1 0 0 0 0 25 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 25 2 0 0 0 0 35 36 1 0 0 0 0 25 24 1 0 0 0 0 31 37 1 6 0 0 0 6 38 1 6 0 0 0 6 39 1 1 0 0 0 31 40 1 1 0 0 0 M END > CFN98117 > Beta-Carotene > 7235-40-7 > 98% > C40H56 > 536.88 > Powder > Miscellaneous > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Carotene-CFN98117.html $$$$ -ISIS- 10201511232D 40 41 0 0 0 0 0 0 0 0999 V2000 -3.8583 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8583 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1792 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1792 -5.8000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8167 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1375 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4542 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9042 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2667 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6292 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6708 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3917 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7542 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4333 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8167 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4542 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2667 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6708 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3917 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1167 -6.1917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7958 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7958 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1167 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4333 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7542 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7250 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7875 -5.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5708 -5.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5083 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 2 0 0 0 0 11 10 1 0 0 0 0 12 11 2 0 0 0 0 13 12 1 0 0 0 0 14 13 2 0 0 0 0 15 14 1 0 0 0 0 16 15 2 0 0 0 0 17 16 1 0 0 0 0 18 17 2 0 0 0 0 19 18 1 0 0 0 0 20 19 2 0 0 0 0 21 20 1 0 0 0 0 22 21 2 0 0 0 0 23 22 1 0 0 0 0 24 23 2 0 0 0 0 4 26 1 0 0 0 0 9 27 1 0 0 0 0 13 28 1 0 0 0 0 18 29 1 0 0 0 0 22 30 1 0 0 0 0 25 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 25 2 0 0 0 0 35 36 1 0 0 0 0 25 24 1 0 0 0 0 31 37 1 6 0 0 0 6 38 1 6 0 0 0 6 39 1 1 0 0 0 31 40 1 1 0 0 0 M END > CFN98117 > Beta-Carotene > 7235-40-7 > 98% > C40H56 > 536.88 > Powder > Miscellaneous > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Carotene-CFN98117.html $$$$ -ISIS- 10201511232D 40 41 0 0 0 0 0 0 0 0999 V2000 -3.8583 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8583 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1792 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1792 -5.8000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8167 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1375 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4542 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9042 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2667 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6292 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6708 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3917 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7542 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4333 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8167 -7.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4542 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2667 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6708 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3917 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1167 -6.1917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7958 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7958 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1167 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4333 -5.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7542 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7250 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7875 -5.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5708 -5.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5083 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 2 0 0 0 0 11 10 1 0 0 0 0 12 11 2 0 0 0 0 13 12 1 0 0 0 0 14 13 2 0 0 0 0 15 14 1 0 0 0 0 16 15 2 0 0 0 0 17 16 1 0 0 0 0 18 17 2 0 0 0 0 19 18 1 0 0 0 0 20 19 2 0 0 0 0 21 20 1 0 0 0 0 22 21 2 0 0 0 0 23 22 1 0 0 0 0 24 23 2 0 0 0 0 4 26 1 0 0 0 0 9 27 1 0 0 0 0 13 28 1 0 0 0 0 18 29 1 0 0 0 0 22 30 1 0 0 0 0 25 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 25 2 0 0 0 0 35 36 1 0 0 0 0 25 24 1 0 0 0 0 31 37 1 6 0 0 0 6 38 1 6 0 0 0 6 39 1 1 0 0 0 31 40 1 1 0 0 0 M END > CFN98117 > Beta-Carotene > 7235-40-7 > 98% > C40H56 > 536.88 > Powder > Miscellaneous > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Carotene-CFN98117.html $$$$ -ISIS- 10201511232D 41 45 0 0 0 0 0 0 0 0999 V2000 4.7375 -8.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -8.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -8.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -8.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8833 -8.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8833 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9458 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1583 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1583 -8.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9458 -8.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -5.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -8.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -6.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -5.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -8.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -6.8750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4542 -7.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2375 -6.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2375 -5.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4542 -5.5125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6667 -5.9667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8833 -5.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0250 -5.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -4.6083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0250 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8083 -6.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3792 -5.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1667 -5.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1667 -4.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3792 -4.1500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5917 -4.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5917 -5.5083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9500 -4.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8083 -4.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3792 -3.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8083 -5.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -3.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 2 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 2 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 1 1 0 0 0 0 6 15 2 0 0 0 0 13 16 1 0 0 0 0 12 17 1 0 0 0 0 10 18 1 0 0 0 0 8 19 1 0 0 0 0 20 9 1 1 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 20 1 0 0 0 0 25 26 1 6 0 0 0 23 27 1 6 0 0 0 24 28 1 1 0 0 0 22 29 1 1 0 0 0 29 30 1 0 0 0 0 31 17 1 1 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 31 1 0 0 0 0 33 37 1 1 0 0 0 35 38 1 1 0 0 0 34 39 1 6 0 0 0 36 40 1 6 0 0 0 37 41 1 0 0 0 0 M END > CFN98122 > Neomangiferin > 64809-67-2 > 98% > C25H28O16 > 584.48 > Powder > Xanthones > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Neomangiferin-CFN98122.html $$$$ -ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 2.3083 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3083 -5.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9250 -5.5708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9250 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -4.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1167 -3.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.9667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9208 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 6 7 1 1 0 0 0 4 8 1 1 0 0 0 3 9 1 6 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 M END > CFN98123 > L-Menthol > 2216-51-5 > 98% > C10H20O > 156.27 > Cryst. > Monoterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/L-Menthol-CFN98123.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 2.3083 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3083 -5.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.0333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9250 -5.5708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9250 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -4.1708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1167 -3.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.9667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9208 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5375 -5.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5375 -4.6375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3417 -6.0333 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 6 7 1 6 0 0 0 4 8 1 6 0 0 0 3 9 1 1 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 8 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 M END > CFN98124 > (1S)-(+)-Menthyl chloroformate > 7635-54-3 > 98% > C11H19ClO2 > 218.72 > Oil > Monoterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/1S-Menthyl-chloroformate-CFN98124.html $$$$ -ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 2.3083 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3083 -5.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.0333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9250 -5.5708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9250 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -4.1708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1167 -3.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.9667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9208 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 6 7 1 6 0 0 0 4 8 1 6 0 0 0 3 9 1 1 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 M END > CFN98125 > D-Menthol > 15356-60-2 > 98% > C10H20O > 156.27 > Cryst. > Monoterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/D-Menthol-CFN98125.html $$$$ -ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 2.3083 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3083 -5.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9250 -5.5708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9250 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -4.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1167 -3.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 6 7 1 1 0 0 0 4 8 1 1 0 0 0 3 9 1 6 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 M END > CFN98126 > Isopulegol > 7786-67-6 > 98% > C10H18O > 154.25 > Oil > Monoterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Isopulegol-CFN98126.html $$$$ -ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 2.3083 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3083 -5.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.0333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9250 -5.5708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9250 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -4.1708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1167 -3.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 6 7 1 6 0 0 0 4 8 1 6 0 0 0 3 9 1 1 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 M END > CFN98127 > (+)-Isopulegol > 104870-56-6 > 98% > C10H18O > 154.25 > Oil > Monoterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Isopulegol-CFN98127.html $$$$ -ISIS- 10201511232D 43 46 0 0 0 0 0 0 0 0999 V2000 6.3083 -5.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0875 -6.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8667 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8667 -5.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0875 -4.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6458 -6.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2042 -6.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9833 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7625 -6.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5417 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5417 -5.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7625 -4.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9833 -5.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5333 -4.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0875 -7.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6458 -4.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3167 -4.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6458 -7.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1208 -5.3958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1208 -6.2958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9000 -6.7458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6750 -6.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -5.3958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9000 -4.9500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9000 -7.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3417 -4.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3417 -6.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -4.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -3.6000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4542 -4.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2333 -3.6000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2333 -2.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4542 -2.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6750 -2.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0125 -4.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4542 -1.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -2.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0125 -2.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1208 -8.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3208 -6.6333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -5.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 4 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 10 1 0 0 0 0 1 16 1 0 0 0 0 3 17 1 0 0 0 0 5 18 1 0 0 0 0 13 19 1 0 0 0 0 7 20 2 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 23 27 1 6 0 0 0 21 28 1 6 0 0 0 22 29 1 1 0 0 0 25 16 1 6 0 0 0 26 30 1 1 0 0 0 31 30 1 1 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 31 1 0 0 0 0 33 37 1 6 0 0 0 35 38 1 6 0 0 0 36 39 1 6 0 0 0 34 40 1 1 0 0 0 27 41 1 0 0 0 0 12 42 1 0 0 0 0 19 43 1 0 0 0 0 M END > CFN98168 > Neosperidin dihydrochalcone > 20702-77-6 > 98% > C28H36O15 > 612.58 > Powder > Chalcones > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Neosperidin-dihydrochalcone-CFN98168.html $$$$ -ISIS- 10201511232D 59 64 0 0 0 0 0 0 0 0999 V2000 3.9000 -7.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6708 -9.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4417 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4417 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6708 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -8.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2167 -7.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7583 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7583 -6.5625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9875 -6.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2167 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -6.1167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3000 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -5.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -5.2250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7583 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -9.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2292 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0708 -5.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -8.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -5.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -6.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4250 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -8.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -5.2250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -8.7875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3583 -7.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8167 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8167 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -9.2333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -10.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -7.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -6.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -4.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -5.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -10.5667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0458 -10.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -10.5667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7250 -11.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0458 -11.9042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8167 -11.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4958 -10.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -12.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4958 -11.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -11.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -10.5667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 1 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 20 47 1 6 0 0 0 15 48 1 6 0 0 0 49 44 1 1 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 49 1 0 0 0 0 51 55 1 1 0 0 0 53 56 1 1 0 0 0 52 57 1 6 0 0 0 54 58 1 6 0 0 0 55 59 1 0 0 0 0 M END > CFN98170 > 20(R)-Ginsenoside Rg3 > 38243-03-7 > 98% > C42H72O13 > 785.02 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/20R-Propanaxadiol-CFN98170.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 2.1458 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -8.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4083 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1667 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -7.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9208 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 12 1 0 0 0 0 M END > CFN98198 > Methyl cinnamate > 103-26-4 > 98% > C10H10O2 > 162.19 > Oil > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Methyl-cinnamate-CFN98198.html $$$$ -ISIS- 10201511232D 31 34 0 0 0 0 0 0 0 0999 V2000 3.8917 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4083 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4083 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -5.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 -4.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9667 -4.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -5.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -7.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -8.3042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9250 -8.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -9.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -10.0583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4500 -9.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4500 -8.7417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2125 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -10.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -10.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9708 -6.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 22 21 1 1 0 0 0 26 29 1 1 0 0 0 25 30 1 1 0 0 0 13 31 1 0 0 0 0 M END > CFN98211 > Guaijaverin > 22255-13-6 > 98% > C20H18O11 > 434.4 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Guaijaverin-CFN98211.html $$$$ -ISIS- 10201511232D 33 35 0 0 0 0 0 0 0 0999 V2000 10.4750 -5.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2625 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0583 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0583 -5.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2625 -4.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6833 -6.5833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8917 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0958 -5.6667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6833 -7.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8917 -7.9583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0958 -7.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -7.9583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3042 -8.8667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0958 -9.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8917 -8.8667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0958 -10.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5125 -7.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6833 -9.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5125 -9.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7208 -7.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 -7.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -8.4167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1292 -7.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3417 -8.4167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3417 -9.3333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1292 -9.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9250 -9.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1292 -10.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5458 -7.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7208 -9.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5458 -9.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -8.4167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 3 0 0 0 0 7 10 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 11 1 0 0 0 0 11 10 1 1 0 0 0 15 17 1 1 0 0 0 13 18 1 1 0 0 0 16 19 1 6 0 0 0 14 20 1 6 0 0 0 18 21 1 0 0 0 0 7 22 1 6 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 23 1 0 0 0 0 23 21 1 1 0 0 0 27 29 1 1 0 0 0 25 30 1 1 0 0 0 28 31 1 6 0 0 0 26 32 1 6 0 0 0 30 33 1 0 0 0 0 M END > CFN98373 > Amygdalin > 29883-15-6 > 98% > C20H27NO11 > 457.4 > Powder > Phenols > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Amygdalin-CFN98373.html $$$$ -ISIS- 10201511232D 39 41 0 0 0 0 0 0 0 0999 V2000 9.7083 -5.5042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7083 -6.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -6.8667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.2875 -6.4167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2875 -5.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -5.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9208 -6.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9208 -5.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -7.7833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -6.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -5.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3417 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5542 -5.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -5.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -5.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1875 -5.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3917 -5.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3917 -6.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1875 -6.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -6.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6042 -6.8667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6708 -6.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -4.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7083 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2875 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7083 -8.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9208 -7.7833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -8.2333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1292 -9.1542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9208 -9.6083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7083 -9.1542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5000 -9.6083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9208 -10.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3417 -9.6083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3417 -7.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5542 -8.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7083 -4.5875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0833 -4.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6042 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 2 0 0 0 0 1 8 1 0 0 0 0 3 9 1 1 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 18 21 1 0 0 0 0 11 22 2 0 0 0 0 6 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 9 1 1 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 26 1 0 0 0 0 31 32 1 6 0 0 0 30 33 1 1 0 0 0 29 34 1 6 0 0 0 28 35 1 1 0 0 0 35 36 1 0 0 0 0 1 37 1 1 0 0 0 25 38 1 0 0 0 0 17 39 1 0 0 0 0 M END > CFN98416 > Oleuropein > 32619-42-4 > 98% > C25H32O13 > 540.5 > Oil > Iridoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Oleuropein-CFN98416.html $$$$ -ISIS- 10201511232D 23 25 0 0 0 0 0 0 0 0999 V2000 0.0917 -3.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0917 -3.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6083 -4.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1292 -3.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1292 -3.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6083 -3.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -4.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1708 -3.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1708 -3.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -3.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6875 -3.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2083 -3.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7292 -3.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7292 -2.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2083 -2.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6875 -2.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6083 -4.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -4.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2458 -2.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4292 -3.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -3.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6875 -4.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2083 -3.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 3 17 1 0 0 0 0 7 18 2 0 0 0 0 14 19 1 0 0 0 0 1 20 1 0 0 0 0 20 21 1 0 0 0 0 8 22 1 0 0 0 0 22 23 1 0 0 0 0 M END > CFN98423 > Kumatakenin > 3301-49-3 > 98% > C17H14O6 > 314.3 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Kumatakenin-CFN98423.html $$$$ -ISIS- 10201511232D 20 22 0 0 0 0 0 0 0 0999 V2000 3.9208 -5.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -6.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -6.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -6.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -5.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -5.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -6.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9958 -6.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9958 -5.5750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5125 -5.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -5.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5500 -5.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5500 -4.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -4.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5125 -4.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -7.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -7.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -5.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -5.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 10 1 0 0 0 0 7 16 2 0 0 0 0 3 17 1 0 0 0 0 1 18 1 0 0 0 0 5 19 1 0 0 0 0 9 19 1 0 0 0 0 9 10 1 6 0 0 0 17 20 1 0 0 0 0 M END > CFN98489 > Alpinetin > 36052-37-6 > 98% > C16H14O4 > 270.3 > Powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Alpinetin-CFN98489.html $$$$ -ISIS- 10201511232D 20 22 0 0 0 0 0 0 0 0999 V2000 3.9208 -5.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -6.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -6.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -6.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -5.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -5.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -6.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9958 -6.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9958 -5.5750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5125 -5.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -5.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5500 -5.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5500 -4.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -4.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5125 -4.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -7.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -7.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -5.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -5.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 10 1 0 0 0 0 7 16 2 0 0 0 0 3 17 1 0 0 0 0 1 18 1 0 0 0 0 5 19 1 0 0 0 0 9 19 1 0 0 0 0 9 10 1 6 0 0 0 17 20 1 0 0 0 0 M END > CFN98489 > Alpinetin > 36052-37-6 > 98% > C16H14O4 > 270.3 > Powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Alpinetin-CFN98489.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 6.7125 -6.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7125 -7.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5208 -7.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3333 -7.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3333 -6.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5208 -6.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1417 -7.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9458 -7.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9458 -6.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1417 -6.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5208 -8.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9083 -6.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1417 -8.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7542 -6.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5583 -6.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3708 -6.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3708 -5.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5583 -4.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7542 -5.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1708 -4.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1708 -6.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -6.4708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2958 -6.0042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4875 -6.4708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4875 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2958 -7.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1042 -7.4042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9083 -7.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 -8.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6833 -7.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6833 -6.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8792 -6.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9792 -5.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 3 11 1 0 0 0 0 1 12 1 0 0 0 0 7 13 2 0 0 0 0 9 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 17 20 1 0 0 0 0 16 21 1 0 0 0 0 22 12 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 26 29 1 1 0 0 0 25 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 20 33 1 0 0 0 0 M END > CFN98502 > Diosmetin-7-O-beta-D-glucopyranoside > 20126-59-4 > 98% > C22H22O11 > 462.41 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Diosmetin-7-O-D-glucopyranoside-CFN98502.html $$$$ -ISIS- 10201511232D 11 10 0 0 0 0 0 0 0 0999 V2000 3.0500 -7.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7875 -8.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6333 -8.6083 0.0000 N 0 3 3 0 0 0 0 0 0 0 0 0 4.4167 -7.9708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0542 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -8.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 -7.5208 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.6500 -9.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -9.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3458 -9.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5333 -10.3500 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 1 1 0 0 0 0 4 6 1 1 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 M CHG 2 3 1 7 -1 M END > CFN98506 > Stachydrine hydrochloride > 4136-37-2 > 98% > C7H14ClNO2 > 179.64 > Powder > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Stachydrine-hydrochloride-CFN98506.html $$$$ -ISIS- 10201511232D 13 12 0 0 0 0 0 0 0 0999 V2000 2.1333 -14.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -15.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -14.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -15.2167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4167 -14.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2417 -15.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -16.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -14.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2417 -16.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -16.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -16.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4167 -16.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -14.2708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 2 7 2 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 4 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 4 13 1 0 0 0 0 M END > CFN98551 > Citric acid > 77-92-9 > 98% > C6H8O7 > 192.12 > Powder > Miscellaneous > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Citric-acid-CFN98551.html $$$$ -ISIS- 10201511232D 13 12 0 0 0 0 0 0 0 0999 V2000 2.1333 -14.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -15.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -14.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -15.2167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4167 -14.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2417 -15.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -16.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 -14.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2417 -16.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -16.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -16.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4167 -16.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -14.2708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 2 7 2 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 4 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 4 13 1 0 0 0 0 M END > CFN98551 > Citric acid > 77-92-9 > 98% > C6H8O7 > 192.12 > Powder > Miscellaneous > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Citric-acid-CFN98551.html $$$$ -ISIS- 10201511232D 32 34 0 0 0 0 0 0 0 0999 V2000 -0.8250 -8.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -9.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0333 -10.3958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8875 -9.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8875 -8.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0333 -8.4167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7417 -8.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -8.9125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4583 -8.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6833 -8.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5375 -8.9125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5375 -9.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6833 -10.3958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3125 -8.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -8.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3125 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4583 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6833 -7.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3958 -10.3958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 -5.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8792 -7.4292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7375 -6.9333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5917 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4500 -6.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5917 -8.4167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7375 -5.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5958 -5.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5958 -4.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4500 -3.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7375 -3.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 1 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 2 1 0 0 0 0 9 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 9 1 0 0 0 0 10 19 2 0 0 0 0 12 20 1 0 0 0 0 16 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 23 1 1 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 24 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 M END > CFN98552 > Folic acid > 59-30-3 > 98% > C19H19N7O6 > 441.4 > Yellow powder > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Folic-acid-CFN98552.html $$$$ -ISIS- 10201511232D 32 35 0 0 0 0 0 0 0 0999 V2000 4.7292 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -6.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -6.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -6.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -6.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8083 -6.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8083 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -5.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2125 -5.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8458 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3667 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3667 -4.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8458 -4.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -4.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8833 -4.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8833 -5.7083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -5.7042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1750 -5.4042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -5.7042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -6.3042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1750 -6.6083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6958 -6.3042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2125 -6.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1375 -6.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1375 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6208 -5.7083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 3 11 1 0 0 0 0 1 12 1 0 0 0 0 7 13 2 0 0 0 0 9 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 17 20 1 0 0 0 0 16 21 1 0 0 0 0 22 12 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 26 29 1 1 0 0 0 25 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 M END > CFN98565 > Luteolin-7-O-glucoside > 5373-11-5 > 98% > C21H20O11 > 448.38 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Luteolin-7-O-glucoside-CFN98565.html $$$$ -ISIS- 10201511232D 32 35 0 0 0 0 0 0 0 0999 V2000 4.7292 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -6.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -6.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -6.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -6.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8083 -6.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8083 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -5.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2125 -5.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8458 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3667 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3667 -4.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8458 -4.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -4.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8833 -4.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8833 -5.7083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -5.7042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1750 -5.4042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -5.7042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -6.3042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1750 -6.6083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6958 -6.3042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2125 -6.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1375 -6.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1375 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6208 -5.7083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 3 11 1 0 0 0 0 1 12 1 0 0 0 0 7 13 2 0 0 0 0 9 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 17 20 1 0 0 0 0 16 21 1 0 0 0 0 22 12 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 26 29 1 1 0 0 0 25 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 M END > CFN98565 > Luteolin-7-O-glucoside > 5373-11-5 > 98% > C21H20O11 > 448.38 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Luteolin-7-O-glucoside-CFN98565.html $$$$ -ISIS- 10201511232D 16 15 0 0 0 0 0 0 0 0999 V2000 2.3958 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0917 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6542 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4375 -6.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2208 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0042 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9875 -5.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8917 -5.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 2 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 7 6 2 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 2 0 0 0 0 2 13 1 0 0 0 0 6 14 1 0 0 0 0 10 15 1 1 0 0 0 10 16 1 6 0 0 0 M END > CFN98638 > Nerolidol > 40716-66-3 > 98% > C15H26O > 222.4 > Oil > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Nerolidol-CFN98638.html $$$$ -ISIS- 10201511232D 16 15 0 0 0 0 0 0 0 0999 V2000 2.3958 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0917 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6542 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4375 -6.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2208 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0042 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9875 -5.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8917 -5.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 2 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 7 6 2 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 2 0 0 0 0 2 13 1 0 0 0 0 6 14 1 0 0 0 0 10 15 1 1 0 0 0 10 16 1 6 0 0 0 M END > CFN98638 > Nerolidol > 40716-66-3 > 98% > C15H26O > 222.4 > Oil > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Nerolidol-CFN98638.html $$$$ -ISIS- 10201511232D 27 28 0 0 0 0 0 0 0 0999 V2000 -0.1250 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4375 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4375 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9083 -7.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2167 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9958 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7792 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1208 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4625 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2458 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2458 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4625 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0208 -7.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7792 -4.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -4.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0167 -5.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9042 -5.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6833 -5.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7958 -5.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 18 21 1 0 0 0 0 10 22 2 0 0 0 0 12 23 2 0 0 0 0 19 24 1 0 0 0 0 1 25 1 0 0 0 0 25 26 1 0 0 0 0 24 27 1 0 0 0 0 M END > CFN98686 > Curcumin > 458-37-7 > 98% > C21H20O6 > 368.4 > Orange powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Curcumin-CFN98686.html $$$$ -ISIS- 10201511232D 45 49 0 0 0 0 0 0 0 0999 V2000 4.1792 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1792 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7000 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -6.4292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7000 -6.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -6.4292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -6.1292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7792 -6.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7792 -5.5292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2583 -5.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -5.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7792 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6625 -7.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1417 -7.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6208 -7.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -7.6292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1000 -8.2292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6208 -8.5292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1417 -8.2292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6208 -9.1292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6625 -8.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 -8.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0625 -7.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7792 -6.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -5.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -5.2292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8167 -5.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 -6.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7792 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 -4.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3375 -4.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8583 -4.3292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3750 -4.6292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8958 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 -5.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8583 -3.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 -3.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 5 15 1 1 0 0 0 12 16 1 1 0 0 0 2 17 1 1 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 18 1 0 0 0 0 18 17 1 1 0 0 0 22 24 1 1 0 0 0 20 25 1 1 0 0 0 23 26 1 6 0 0 0 21 27 1 6 0 0 0 25 28 1 0 0 0 0 10 29 1 6 0 0 0 11 30 1 6 0 0 0 9 31 1 1 0 0 0 12 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 11 34 1 0 0 0 0 32 35 1 0 0 0 0 35 36 1 6 0 0 0 32 37 1 6 0 0 0 38 35 1 0 0 0 0 39 38 1 0 0 0 0 40 39 1 0 0 0 0 41 40 1 0 0 0 0 42 41 1 0 0 0 0 41 43 1 0 0 0 0 40 44 1 1 0 0 0 44 45 1 0 0 0 0 M END > CFN98713 > Daucosterol > 474-58-8 > 98% > C35H60O6 > 576.9 > Powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Daucosterol-CFN98713.html $$$$ -ISIS- 10201511232D 45 49 0 0 0 0 0 0 0 0999 V2000 4.1792 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1792 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7000 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -6.4292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7000 -6.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -6.4292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -6.1292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7792 -6.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7792 -5.5292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2583 -5.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -5.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7792 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6625 -7.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1417 -7.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6208 -7.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -7.6292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1000 -8.2292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6208 -8.5292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1417 -8.2292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6208 -9.1292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6625 -8.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 -8.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0625 -7.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7792 -6.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -5.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -5.2292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8167 -5.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 -6.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7792 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 -4.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3375 -4.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8583 -4.3292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3750 -4.6292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8958 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 -5.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8583 -3.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 -3.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 5 15 1 1 0 0 0 12 16 1 1 0 0 0 2 17 1 1 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 18 1 0 0 0 0 18 17 1 1 0 0 0 22 24 1 1 0 0 0 20 25 1 1 0 0 0 23 26 1 6 0 0 0 21 27 1 6 0 0 0 25 28 1 0 0 0 0 10 29 1 6 0 0 0 11 30 1 6 0 0 0 9 31 1 1 0 0 0 12 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 11 34 1 0 0 0 0 32 35 1 0 0 0 0 35 36 1 6 0 0 0 32 37 1 6 0 0 0 38 35 1 0 0 0 0 39 38 1 0 0 0 0 40 39 1 0 0 0 0 41 40 1 0 0 0 0 42 41 1 0 0 0 0 41 43 1 0 0 0 0 40 44 1 1 0 0 0 44 45 1 0 0 0 0 M END > CFN98713 > Daucosterol > 474-58-8 > 98% > C35H60O6 > 576.9 > Powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Daucosterol-CFN98713.html $$$$ -ISIS- 10201511232D 45 49 0 0 0 0 0 0 0 0999 V2000 4.1792 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1792 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7000 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -6.4292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7000 -6.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -6.4292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -6.1292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7792 -6.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7792 -5.5292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2583 -5.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -5.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -5.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7792 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6625 -7.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1417 -7.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6208 -7.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -7.6292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1000 -8.2292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6208 -8.5292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1417 -8.2292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6208 -9.1292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 -7.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6625 -8.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 -8.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0625 -7.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7792 -6.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -5.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -5.2292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8167 -5.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 -6.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7792 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 -4.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3375 -4.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8583 -4.3292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3750 -4.6292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8958 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 -5.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8583 -3.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 -3.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 5 15 1 1 0 0 0 12 16 1 1 0 0 0 2 17 1 1 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 18 1 0 0 0 0 18 17 1 1 0 0 0 22 24 1 1 0 0 0 20 25 1 1 0 0 0 23 26 1 6 0 0 0 21 27 1 6 0 0 0 25 28 1 0 0 0 0 10 29 1 6 0 0 0 11 30 1 6 0 0 0 9 31 1 1 0 0 0 12 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 11 34 1 0 0 0 0 32 35 1 0 0 0 0 35 36 1 6 0 0 0 32 37 1 6 0 0 0 38 35 1 0 0 0 0 39 38 1 0 0 0 0 40 39 1 0 0 0 0 41 40 1 0 0 0 0 42 41 1 0 0 0 0 41 43 1 0 0 0 0 40 44 1 1 0 0 0 44 45 1 0 0 0 0 M END > CFN98713 > Daucosterol > 474-58-8 > 98% > C35H60O6 > 576.9 > Powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Daucosterol-CFN98713.html $$$$ -ISIS- 10201511232D 30 33 0 0 0 0 0 0 0 0999 V2000 3.6958 -6.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -6.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2167 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -6.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -6.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2167 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -7.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7750 -6.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7750 -6.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -6.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -6.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -6.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -7.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2167 -5.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1375 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1375 -6.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -5.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -6.0083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8125 -6.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -6.0083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3292 -5.4083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8125 -5.1083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2917 -5.4083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7750 -5.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -5.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8125 -4.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -6.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3667 -6.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 2 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 2 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 1 1 0 0 0 0 6 15 2 0 0 0 0 13 16 1 0 0 0 0 12 17 1 0 0 0 0 10 18 1 0 0 0 0 8 19 1 0 0 0 0 20 9 1 1 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 20 1 0 0 0 0 25 26 1 6 0 0 0 23 27 1 6 0 0 0 24 28 1 1 0 0 0 22 29 1 1 0 0 0 29 30 1 0 0 0 0 M END > CFN98719 > Mangiferin > 4773-96-0 > 98% > C19H18O11 > 422.3 > Powder > Xanthones > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Mangiferin-CFN98719.html $$$$ -ISIS- 10201511232D 19 21 0 0 0 0 0 0 0 0999 V2000 4.4833 -6.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4833 -7.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2708 -7.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0583 -7.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0583 -6.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2708 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8458 -7.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6333 -7.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6333 -6.2667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4208 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2083 -6.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9958 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9958 -4.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2083 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4208 -4.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8458 -8.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2708 -8.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -5.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8458 -5.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 10 1 0 0 0 0 7 16 2 0 0 0 0 3 17 1 0 0 0 0 1 18 1 0 0 0 0 5 19 1 0 0 0 0 9 19 1 0 0 0 0 9 10 1 6 0 0 0 M END > CFN98740 > Pinocembrin > 480-39-7 > 98% > C15H12O4 > 256.3 > Powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Pinocembrin-CFN98740.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 3.4333 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 -6.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -6.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -6.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -6.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -5.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -4.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -4.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5875 -4.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -6.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9125 -5.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.3667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5083 -7.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -7.8667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0292 -8.1667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5500 -7.8667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5500 -7.2667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0708 -6.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -8.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -8.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -8.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -8.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5917 -5.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 22 21 1 1 0 0 0 26 29 1 1 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 25 30 1 6 0 0 0 13 33 1 0 0 0 0 M END > CFN98753 > Isoquercitrin > 482-35-9 > 98% > C21H20O12 > 464.4 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Isoquercitrin-CFN98753.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 3.4333 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 -6.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -6.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -6.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -6.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -5.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -4.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -4.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5875 -4.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -6.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9125 -5.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.3667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5083 -7.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -7.8667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0292 -8.1667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5500 -7.8667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5500 -7.2667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0708 -6.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -8.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -8.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -8.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -8.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5917 -5.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 22 21 1 1 0 0 0 26 29 1 1 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 25 30 1 6 0 0 0 13 33 1 0 0 0 0 M END > CFN98753 > Isoquercitrin > 482-35-9 > 98% > C21H20O12 > 464.4 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Isoquercitrin-CFN98753.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 3.4333 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 -6.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -6.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -6.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -6.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -5.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -4.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -4.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -4.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5875 -4.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -6.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9125 -5.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.3667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5083 -7.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -7.8667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0292 -8.1667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5500 -7.8667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5500 -7.2667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0708 -6.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -8.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -8.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -8.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -8.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5917 -5.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 22 21 1 1 0 0 0 26 29 1 1 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 25 30 1 6 0 0 0 13 33 1 0 0 0 0 M END > CFN98753 > Isoquercitrin > 482-35-9 > 98% > C21H20O12 > 464.4 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Isoquercitrin-CFN98753.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 3.8917 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4083 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4083 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -5.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 -4.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9667 -4.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -5.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -7.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -8.3042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9250 -8.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -9.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6875 -10.0583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4500 -9.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4500 -8.7417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2125 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -10.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -10.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -10.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -10.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9708 -6.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 22 21 1 1 0 0 0 26 29 1 1 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 25 30 1 1 0 0 0 13 33 1 0 0 0 0 M END > CFN98754 > Hyperoside > 482-36-0 > 98% > C21H20O12 > 464.4 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Hyperin-CFN98754.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 3.8917 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4083 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4083 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -5.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 -4.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9667 -4.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -5.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -7.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -8.3042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9250 -8.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -9.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6875 -10.0583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4500 -9.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4500 -8.7417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2125 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -10.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -10.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -10.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -10.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9708 -6.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 22 21 1 1 0 0 0 26 29 1 1 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 25 30 1 1 0 0 0 13 33 1 0 0 0 0 M END > CFN98754 > Hyperoside > 482-36-0 > 98% > C21H20O12 > 464.4 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Hyperin-CFN98754.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 3.8917 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4083 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4083 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -5.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 -6.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 -4.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9667 -4.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6458 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -5.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -7.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -8.3042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9250 -8.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -9.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6875 -10.0583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4500 -9.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4500 -8.7417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2125 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2125 -10.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -10.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -10.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -10.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9708 -6.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 22 21 1 1 0 0 0 26 29 1 1 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 25 30 1 1 0 0 0 13 33 1 0 0 0 0 M END > CFN98754 > Hyperoside > 482-36-0 > 98% > C21H20O12 > 464.4 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Hyperin-CFN98754.html $$$$ -ISIS- 10201511232D 21 23 0 0 0 0 0 0 0 0999 V2000 3.9625 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9625 -7.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7458 -8.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5292 -7.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5292 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7458 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -8.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -7.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4458 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4458 -5.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -5.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -5.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2292 -5.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -9.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7458 -9.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2292 -6.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 13 21 1 0 0 0 0 M END > CFN98784 > Luteolin > 491-70-3 > 98% > C15H10O6 > 286.2 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Luteolin-CFN98784.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 10 30 1 6 0 0 0 4 31 1 6 0 0 0 23 32 1 0 0 0 0 23 33 2 0 0 0 0 28 34 1 6 0 0 0 28 35 1 1 0 0 0 2 19 1 1 0 0 0 18 36 1 1 0 0 0 M END > CFN98800 > Oleanolic acid > 508-02-1 > 98% > C30H48O3 > 456.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Oleanolic-acid-CFN98800.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 10 30 1 6 0 0 0 4 31 1 6 0 0 0 23 32 1 0 0 0 0 23 33 2 0 0 0 0 28 34 1 6 0 0 0 28 35 1 1 0 0 0 2 19 1 1 0 0 0 18 36 1 1 0 0 0 M END > CFN98800 > Oleanolic acid > 508-02-1 > 98% > C30H48O3 > 456.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Oleanolic-acid-CFN98800.html $$$$ -ISIS- 10201511232D 43 47 0 0 0 0 0 0 0 0999 V2000 3.9208 -12.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -13.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -13.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -13.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -12.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -12.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -13.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -13.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -12.4417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4792 -12.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5208 -12.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -12.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5583 -12.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5583 -11.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -11.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5208 -11.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -13.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 -11.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -13.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4042 -12.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4042 -11.5458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9208 -11.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -10.6458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4042 -10.3458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8833 -10.6458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8833 -11.2458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3625 -11.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3625 -10.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4042 -9.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -10.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -10.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -10.3458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0000 -10.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5208 -10.3458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5208 -9.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0000 -9.4458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4792 -9.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9583 -9.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -8.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -9.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -10.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5958 -11.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0792 -12.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 3 17 1 0 0 0 0 14 18 1 0 0 0 0 7 19 2 0 0 0 0 1 20 1 0 0 0 0 21 20 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 26 27 1 6 0 0 0 25 28 1 1 0 0 0 24 29 1 6 0 0 0 23 30 1 1 0 0 0 30 31 1 0 0 0 0 32 31 1 1 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 32 1 0 0 0 0 37 38 1 6 0 0 0 36 39 1 6 0 0 0 35 40 1 1 0 0 0 34 41 1 6 0 0 0 9 11 1 6 0 0 0 18 42 1 0 0 0 0 13 43 1 0 0 0 0 M END > CFN98839 > Hesperidin > 520-26-3 > 98% > C28H34O15 > 610.6 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Hesperidin-CFN98839.html $$$$ -ISIS- 10201511232D 43 47 0 0 0 0 0 0 0 0999 V2000 3.9208 -12.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -13.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -13.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -13.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -12.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -12.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -13.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -13.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -12.4417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4792 -12.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5208 -12.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -12.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5583 -12.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5583 -11.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -11.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5208 -11.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -13.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 -11.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -13.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4042 -12.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4042 -11.5458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9208 -11.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -10.6458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4042 -10.3458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8833 -10.6458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8833 -11.2458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3625 -11.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3625 -10.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4042 -9.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -10.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -10.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -10.3458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0000 -10.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5208 -10.3458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5208 -9.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0000 -9.4458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4792 -9.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9583 -9.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -8.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -9.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -10.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5958 -11.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0792 -12.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 3 17 1 0 0 0 0 14 18 1 0 0 0 0 7 19 2 0 0 0 0 1 20 1 0 0 0 0 21 20 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 26 27 1 6 0 0 0 25 28 1 1 0 0 0 24 29 1 6 0 0 0 23 30 1 1 0 0 0 30 31 1 0 0 0 0 32 31 1 1 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 32 1 0 0 0 0 37 38 1 6 0 0 0 36 39 1 6 0 0 0 35 40 1 1 0 0 0 34 41 1 6 0 0 0 9 11 1 6 0 0 0 18 42 1 0 0 0 0 13 43 1 0 0 0 0 M END > CFN98839 > Hesperidin > 520-26-3 > 98% > C28H34O15 > 610.6 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Hesperidin-CFN98839.html $$$$ -ISIS- 10201511232D 22 24 0 0 0 0 0 0 0 0999 V2000 3.9500 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -8.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2792 -8.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0542 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0542 -6.9625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2792 -6.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2792 -9.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8333 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3875 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3875 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -5.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8333 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -9.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1708 -6.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1625 -5.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -4.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9417 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 12 1 0 0 0 0 3 18 1 0 0 0 0 1 19 1 0 0 0 0 15 20 1 0 0 0 0 16 21 1 0 0 0 0 20 22 1 0 0 0 0 9 12 1 6 0 0 0 M END > CFN98842 > Hesperetin > 520-33-2 > 98% > C16H14O6 > 302.3 > Powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Hesperetin-CFN98842.html $$$$ -ISIS- 10201511232D 22 24 0 0 0 0 0 0 0 0999 V2000 3.9500 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -8.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2792 -8.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0542 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0542 -6.9625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2792 -6.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2792 -9.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8333 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3875 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3875 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -5.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8333 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -9.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1708 -6.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1625 -5.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -4.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9417 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 12 1 0 0 0 0 3 18 1 0 0 0 0 1 19 1 0 0 0 0 15 20 1 0 0 0 0 16 21 1 0 0 0 0 20 22 1 0 0 0 0 9 12 1 6 0 0 0 M END > CFN98842 > Hesperetin > 520-33-2 > 98% > C16H14O6 > 302.3 > Powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Hesperetin-CFN98842.html $$$$ -ISIS- 10201511232D 20 22 0 0 0 0 0 0 0 0999 V2000 4.0250 -6.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6208 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6208 -6.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -5.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4208 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2167 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2167 -6.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4208 -5.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0167 -5.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8125 -6.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6125 -5.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6125 -5.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8125 -4.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0167 -5.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4208 -8.7583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2292 -5.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -8.7583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4125 -4.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 7 17 2 0 0 0 0 1 18 1 0 0 0 0 3 19 1 0 0 0 0 14 20 1 0 0 0 0 9 11 1 0 0 0 0 M END > CFN98843 > Apigenin > 520-36-5 > 98% > C15H10O5 > 270.2 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Apigenin-CFN98843.html $$$$ -ISIS- 10201511232D 32 35 0 0 0 0 0 0 0 0999 V2000 7.0563 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0563 -12.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 -12.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0956 -12.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0956 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 -11.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -12.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1348 -12.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1348 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -11.6927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -11.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1740 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6937 -11.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6937 -11.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1740 -10.7927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -11.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2133 -10.7927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -13.4927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 -13.4927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5367 -11.6927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -12.8927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -13.4927 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1348 -13.7927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1348 -14.3927 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6544 -14.6927 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1740 -14.3927 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1740 -13.7927 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6937 -13.4927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6937 -14.6927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -14.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -15.2927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2133 -11.9927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 26 29 1 6 0 0 0 24 30 1 6 0 0 0 25 31 1 1 0 0 0 22 21 1 1 0 0 0 13 32 1 0 0 0 0 M END > CFN98850 > Quercitrin > 522-12-3 > 98% > C21H20O11 > 448.4 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Quercitrin-CFN98850.html $$$$ -ISIS- 10201511232D 32 35 0 0 0 0 0 0 0 0999 V2000 7.0563 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0563 -12.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 -12.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0956 -12.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0956 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 -11.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -12.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1348 -12.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1348 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -11.6927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -11.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1740 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6937 -11.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6937 -11.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1740 -10.7927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -11.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2133 -10.7927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -13.4927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 -13.4927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5367 -11.6927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -12.8927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -13.4927 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1348 -13.7927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1348 -14.3927 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6544 -14.6927 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1740 -14.3927 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1740 -13.7927 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6937 -13.4927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6937 -14.6927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -14.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -15.2927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2133 -11.9927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 26 29 1 6 0 0 0 24 30 1 6 0 0 0 25 31 1 1 0 0 0 22 21 1 1 0 0 0 13 32 1 0 0 0 0 M END > CFN98850 > Quercitrin > 522-12-3 > 98% > C21H20O11 > 448.4 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Quercitrin-CFN98850.html $$$$ -ISIS- 10201511232D 32 35 0 0 0 0 0 0 0 0999 V2000 7.0563 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0563 -12.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 -12.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0956 -12.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0956 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 -11.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -12.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1348 -12.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1348 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -11.6927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -11.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1740 -11.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6937 -11.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6937 -11.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1740 -10.7927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -11.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2133 -10.7927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -13.4927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 -13.4927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5367 -11.6927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -12.8927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -13.4927 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1348 -13.7927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1348 -14.3927 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6544 -14.6927 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1740 -14.3927 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1740 -13.7927 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6937 -13.4927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6937 -14.6927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -14.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6544 -15.2927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2133 -11.9927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 6 0 0 0 26 29 1 6 0 0 0 24 30 1 6 0 0 0 25 31 1 1 0 0 0 22 21 1 1 0 0 0 13 32 1 0 0 0 0 M END > CFN98850 > Quercitrin > 522-12-3 > 98% > C21H20O11 > 448.4 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Quercitrin-CFN98850.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.9750 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -8.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -8.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6458 -8.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6458 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -6.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -6.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6458 -5.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -9.8667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -8.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -5.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 3 9 1 0 0 0 0 2 10 1 0 0 0 0 4 11 1 0 0 0 0 7 12 2 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 M END > CFN98884 > Syringic acid > 530-57-4 > 98% > C9H10O5 > 198.2 > Powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Syringic-acid-CFN98884.html $$$$ -ISIS- 10201511232D 35 39 0 0 0 0 0 0 0 0999 V2000 1.7125 -7.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7125 -8.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5042 -8.7083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2917 -8.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2917 -7.3417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5042 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0833 -8.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8708 -8.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8708 -7.3417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0833 -6.8875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6625 -6.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6625 -5.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8708 -5.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0833 -5.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -7.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2375 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2375 -5.9750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4500 -5.5167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9250 -8.7083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2917 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8708 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0292 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -7.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9583 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0292 -5.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0292 -4.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2375 -4.1500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4500 -4.6083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2917 -9.1625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0833 -7.7958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2375 -3.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -6.4292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -4.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8167 -5.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 2 19 1 1 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 4 30 1 6 0 0 0 10 31 1 6 0 0 0 28 32 1 6 0 0 0 18 33 1 1 0 0 0 29 34 1 1 0 0 0 23 35 1 0 0 0 0 M END > CFN98912 > Uvaol > 545-46-0 > 98% > C30H50O2 > 442.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Uvaol-CFN98912.html $$$$ -ISIS- 10201511232D 35 39 0 0 0 0 0 0 0 0999 V2000 3.9250 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7083 -8.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5042 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8750 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8750 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0792 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -6.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2458 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -4.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2458 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -4.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -3.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -7.8625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -8.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2542 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -5.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -6.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 1 1 0 0 0 3 32 1 6 0 0 0 3 33 1 1 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 M END > CFN98913 > Lupeol > 545-47-1 > 98% > C30H50O > 426.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Lupeol-CFN98913.html $$$$ -ISIS- 10201511232D 20 22 0 0 0 0 0 0 0 0999 V2000 2.1375 -1.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1375 -2.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -2.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -2.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -1.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -1.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -2.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2167 -2.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2167 -1.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -1.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -1.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7750 -1.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7750 -1.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -0.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -1.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -3.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6167 -1.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -3.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -2.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 3 17 1 0 0 0 0 1 18 1 0 0 0 0 7 19 2 0 0 0 0 8 20 1 0 0 0 0 M END > CFN98918 > Galangin > 548-83-4 > 98% > C15H10O5 > 270.2 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Galangin-CFN98918.html $$$$ -ISIS- 10201511232D 34 38 0 0 0 0 0 0 0 0999 V2000 4.7042 -7.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7042 -8.6333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4750 -9.0833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2542 -8.6333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2542 -7.7375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4750 -7.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8042 -8.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8042 -7.7375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0333 -7.2875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5833 -7.2875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -6.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8042 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -6.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3625 -7.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1417 -7.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1417 -6.3917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3625 -5.9417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2542 -6.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8042 -6.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9125 -6.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9125 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9125 -5.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1417 -4.5958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3625 -5.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -8.1875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6917 -3.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -3.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -9.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -5.4958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -9.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -9.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -9.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 5 19 1 1 0 0 0 9 20 1 1 0 0 0 17 21 1 1 0 0 0 11 22 1 6 0 0 0 17 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 18 1 0 0 0 0 10 27 1 6 0 0 0 25 28 1 1 0 0 0 25 29 1 6 0 0 0 2 30 1 1 0 0 0 18 31 1 1 0 0 0 4 32 1 6 0 0 0 3 33 1 6 0 0 0 3 34 1 1 0 0 0 M END > CFN98935 > beta-Amyrin > 559-70-6 > 98% > C30H50O > 426.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/beta-Amyrin-CFN98935.html $$$$ -ISIS- 10201511232D 32 35 0 0 0 0 0 0 0 0999 V2000 2.9958 -9.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9958 -9.9417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7792 -10.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5625 -9.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5625 -9.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7792 -8.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -10.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1333 -9.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1333 -9.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -8.5833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9167 -8.5833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9167 -7.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1333 -7.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -7.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 -7.2250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4833 -7.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -8.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 -6.3167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9167 -5.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -5.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2667 -6.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0500 -5.8667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8375 -6.3167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6208 -5.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0500 -4.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -7.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9167 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5625 -8.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -9.4875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -6.7708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2125 -10.3917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9167 -9.4875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 11 1 0 0 0 0 18 19 1 6 0 0 0 20 18 1 0 0 0 0 21 20 2 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 22 25 1 6 0 0 0 23 26 1 0 0 0 0 12 27 1 1 0 0 0 5 28 1 1 0 0 0 15 18 1 0 0 0 0 10 29 1 6 0 0 0 15 30 1 6 0 0 0 2 31 1 1 0 0 0 11 32 1 6 0 0 0 M END > CFN98980 > Ergosterol > 57-87-4 > 98% > C28H44O > 396.7 > Powder > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ergosterol-CFN98980.html $$$$ -ISIS- 10201511232D 17 16 0 0 0 0 0 0 0 0999 V2000 2.3958 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0917 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6542 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4375 -6.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2208 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0042 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -5.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9875 -5.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8917 -5.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 2 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 7 6 2 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 2 0 0 0 0 2 13 1 0 0 0 0 4 14 2 0 0 0 0 6 15 1 0 0 0 0 10 16 1 1 0 0 0 10 17 1 6 0 0 0 M END > CFN98997 > 9-Oxonerolidol > 58865-88-6 > 98% > C15H24O2 > 236.4 > Oil > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/9-Oxonerolidol-CFN98997.html $$$$ -ISIS- 10201511232D 32 35 0 0 0 0 0 0 0 0999 V2000 2.3958 -6.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3958 -6.8250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9167 -7.1250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4333 -6.8250 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4333 -6.2250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9167 -5.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9542 -7.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -6.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -6.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9542 -5.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -5.9250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9917 -5.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4750 -5.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9542 -5.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5125 -5.0250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0333 -5.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0333 -5.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -4.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 -5.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5125 -4.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9917 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0333 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5542 -4.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5917 -4.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1125 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5917 -5.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6167 -7.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2167 -7.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6292 -4.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -7.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 2 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 11 20 1 6 0 0 0 15 21 1 1 0 0 0 21 22 1 6 0 0 0 23 21 1 0 0 0 0 24 23 1 0 0 0 0 25 24 1 0 0 0 0 26 25 2 0 0 0 0 27 26 1 0 0 0 0 26 28 1 0 0 0 0 3 29 1 1 0 0 0 3 30 1 6 0 0 0 27 31 1 0 0 0 0 2 32 1 1 0 0 0 M END > CFN99064 > Ganoderol B > 104700-96-1 > 98% > C30H48O2 > 440.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderol-B-CFN99064.html $$$$ -ISIS- 10201511232D 32 35 0 0 0 0 0 0 0 0999 V2000 2.2458 -9.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 -10.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7667 -10.6500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2875 -10.3500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2875 -9.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7667 -9.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -10.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -9.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -9.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -9.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8458 -8.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3250 -8.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -8.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -8.5500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8833 -8.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -9.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -8.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2875 -9.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -10.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -10.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -7.9500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8458 -7.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -7.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4042 -7.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -7.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -7.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9625 -7.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -8.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4667 -11.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0667 -11.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -7.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 2 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 2 20 2 0 0 0 0 11 21 1 6 0 0 0 15 22 1 1 0 0 0 22 23 1 6 0 0 0 24 22 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 27 26 2 0 0 0 0 28 27 1 0 0 0 0 27 29 1 0 0 0 0 3 30 1 1 0 0 0 3 31 1 6 0 0 0 28 32 1 0 0 0 0 M END > CFN99065 > Ganoderol A > 104700-97-2 > 98% > C30H46O2 > 438.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderol-A-CFN99065.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 2.2458 -7.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 -7.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7667 -7.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2875 -7.6458 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2875 -7.0458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7667 -6.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -7.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -7.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -6.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -6.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8458 -6.1458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3250 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -6.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -5.8458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8833 -6.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -6.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -5.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2875 -6.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -7.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -7.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -5.2458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8458 -4.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -4.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4042 -5.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -4.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -5.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9625 -4.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -5.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4667 -8.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0667 -8.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9625 -4.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 2 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 2 20 2 0 0 0 0 11 21 1 6 0 0 0 15 22 1 1 0 0 0 22 23 1 6 0 0 0 24 22 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 27 26 2 0 0 0 0 28 27 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 3 31 1 1 0 0 0 3 32 1 6 0 0 0 28 33 2 0 0 0 0 M END > CFN99066 > Ganoderic acid S > 104759-35-5 > 98% > C30H44O3 > 452.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderic-acid-S-CFN99066.html $$$$ -ISIS- 10201511232D 34 37 0 0 0 0 0 0 0 0999 V2000 2.2458 -7.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 -7.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7667 -7.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2875 -7.6458 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2875 -7.0458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7667 -6.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -7.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -7.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -6.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -6.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8458 -6.1458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3250 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -6.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -5.8458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8833 -6.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -6.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -5.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2875 -6.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -7.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -7.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -5.2458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8458 -4.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -4.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4042 -5.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -4.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4417 -5.2458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9625 -4.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4667 -8.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0667 -8.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -4.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9625 -5.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -5.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 2 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 2 20 2 0 0 0 0 11 21 1 6 0 0 0 15 22 1 1 0 0 0 22 23 1 6 0 0 0 24 22 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 27 26 1 0 0 0 0 28 27 1 0 0 0 0 27 29 1 0 0 0 0 3 30 1 1 0 0 0 3 31 1 6 0 0 0 28 34 1 0 0 0 0 26 32 1 6 0 0 0 27 33 1 1 0 0 0 M END > CFN99077 > Ganodermanontriol > 106518-63-2 > 98% > C30H48O4 > 472.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganodermanontriol-CFN99077.html $$$$ -ISIS- 10201511232D 26 27 0 0 0 0 0 0 0 0999 V2000 5.1833 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1125 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5792 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7167 -4.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7875 -4.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7167 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -3.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3958 -5.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9708 -5.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3208 -7.5875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2500 -7.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9708 -6.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8542 -8.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -8.3917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7125 -8.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2500 -9.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7125 -10.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6417 -10.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1083 -9.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6417 -8.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0375 -9.1958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1083 -10.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3208 -9.1958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 2 0 0 0 0 4 3 1 0 0 0 0 1 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 1 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 4 12 2 0 0 0 0 13 14 1 0 0 0 0 15 4 1 0 0 0 0 16 13 1 0 0 0 0 17 16 1 0 0 0 0 14 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 18 1 0 0 0 0 22 24 1 0 0 0 0 21 25 1 0 0 0 0 16 26 2 0 0 0 0 13 15 1 6 0 0 0 M END > CFN99103 > Rosmarinic acid > 20283-92-5 > 98% > C18H16O8 > 360.31 > Powder > Phenylpropanoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Rosmarinic-acid-CFN99103.html $$$$ -ISIS- 10201511232D 32 35 0 0 0 0 0 0 0 0999 V2000 5.7833 -5.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7833 -6.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5792 -6.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3625 -6.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3625 -5.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5792 -4.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1542 -6.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9500 -6.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9500 -5.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1542 -4.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7417 -4.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5250 -5.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3167 -4.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3167 -3.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5250 -3.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7417 -3.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1542 -7.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5792 -7.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -4.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -3.9750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7833 -3.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7833 -2.6042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9917 -2.1458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2000 -2.6042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2000 -3.5167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5750 -2.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4083 -2.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -1.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4083 -3.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 -1.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -2.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9958 -6.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 7 17 2 0 0 0 0 3 18 1 0 0 0 0 1 19 1 0 0 0 0 20 19 1 1 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 20 1 0 0 0 0 22 26 1 1 0 0 0 24 27 1 1 0 0 0 23 28 1 6 0 0 0 25 29 1 6 0 0 0 26 30 1 0 0 0 0 26 31 2 0 0 0 0 2 32 1 0 0 0 0 M END > CFN99111 > Baicalin > 21967-41-9 > 98% > C21H18O11 > 446.37 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Baicalin-CFN99111.html $$$$ -ISIS- 10201511232D 43 47 0 0 0 0 0 0 0 0999 V2000 3.3458 -12.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3458 -13.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -13.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8917 -13.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8917 -12.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -11.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6667 -13.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4417 -13.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4417 -12.2292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6667 -11.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2208 -11.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9875 -12.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7625 -11.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7625 -10.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9875 -10.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2208 -10.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -14.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6667 -14.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5792 -11.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5792 -10.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3458 -10.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3458 -9.5542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5792 -9.1083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8042 -9.5542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8042 -10.4458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0292 -10.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0292 -9.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5792 -8.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -9.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8917 -9.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0292 -11.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2542 -12.2333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2542 -13.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0292 -13.5750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8000 -13.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8000 -12.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -13.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5208 -11.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5208 -13.5750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0292 -14.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5333 -12.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9875 -9.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7583 -9.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 3 17 1 0 0 0 0 7 18 2 0 0 0 0 1 19 1 0 0 0 0 20 19 1 1 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 20 1 0 0 0 0 25 26 1 6 0 0 0 24 27 1 1 0 0 0 23 28 1 6 0 0 0 22 29 1 1 0 0 0 29 30 1 0 0 0 0 9 11 1 6 0 0 0 31 26 1 6 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 31 1 0 0 0 0 35 37 1 1 0 0 0 32 38 1 1 0 0 0 33 39 1 1 0 0 0 34 40 1 6 0 0 0 13 41 1 0 0 0 0 15 42 1 0 0 0 0 42 43 1 0 0 0 0 M END > CFN99125 > Neohesperidin > 13241-33-3 > 98% > C28H34O15 > 610.56 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Neohesperidin-CFN99125.html $$$$ -ISIS- 10201511232D 23 23 0 0 0 0 0 0 0 0999 V2000 0.0833 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0833 -2.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8792 -3.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -2.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8792 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4667 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2625 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -1.1958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -0.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -3.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -0.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -1.1958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4375 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2333 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6125 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -0.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4083 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2042 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 1 10 1 0 0 0 0 10 11 1 0 0 0 0 2 12 1 0 0 0 0 9 13 1 0 0 0 0 9 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 15 21 1 1 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 M END > CFN99131 > 8-Gingerol > 23513-08-8 > 98% > C19H30O4 > 322.44 > Powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/8-Gingerol-CFN99131.html $$$$ -ISIS- 10201511232D 25 25 0 0 0 0 0 0 0 0999 V2000 0.0833 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0833 -2.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8792 -3.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -2.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8792 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4667 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2625 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -1.1958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -0.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -3.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -0.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -1.1958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4375 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2333 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6125 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -0.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4083 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2042 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7958 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 1 10 1 0 0 0 0 10 11 1 0 0 0 0 2 12 1 0 0 0 0 9 13 1 0 0 0 0 9 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 15 21 1 1 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 M END > CFN99132 > 10-Gingerol > 23513-15-7 > 98% > C21H34O4 > 350.49 > Powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/10-Gingerol-CFN99132.html $$$$ -ISIS- 10201511232D 70 77 0 0 0 0 0 0 0 0999 V2000 2.2708 -12.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2708 -12.9167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0208 -13.3458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7667 -12.9167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7667 -12.0542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0208 -11.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -13.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -12.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -12.0542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5125 -11.6208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0125 -11.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0125 -10.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -10.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -10.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 -12.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -11.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -10.7583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7500 -10.3292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5208 -13.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5875 -14.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7667 -11.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -11.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2458 -11.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0125 -12.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 -14.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2458 -10.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2458 -9.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -9.0333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7500 -9.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0667 -8.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9292 -8.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7667 -13.7792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -12.4833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9958 -10.7583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2458 -12.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7833 -12.9167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7833 -12.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0375 -11.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7125 -12.0542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7125 -12.9167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0375 -13.3458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0375 -14.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4542 -13.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4542 -11.6208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 -11.1917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0375 -10.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7042 -10.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7833 -10.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7458 -11.1917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7458 -12.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4917 -12.4833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.2375 -12.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.2375 -11.1917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4917 -10.7583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9833 -10.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4917 -13.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -12.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9833 -12.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7292 -11.1917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7083 -14.6417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4542 -14.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -14.6417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2000 -15.5042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4542 -15.9333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7083 -15.5042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4542 -16.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0375 -15.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -15.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -14.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6917 -14.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 34 23 1 0 0 0 0 23 35 2 0 0 0 0 2 19 1 1 0 0 0 36 19 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 41 42 1 6 0 0 0 40 43 1 1 0 0 0 39 44 1 6 0 0 0 18 45 1 1 0 0 0 38 46 1 1 0 0 0 46 47 1 0 0 0 0 46 48 2 0 0 0 0 49 34 1 6 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 49 1 0 0 0 0 53 55 1 6 0 0 0 51 56 1 6 0 0 0 50 57 1 1 0 0 0 52 58 1 1 0 0 0 55 59 1 0 0 0 0 60 42 1 1 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 65 60 1 0 0 0 0 64 66 1 1 0 0 0 65 67 1 6 0 0 0 63 68 1 6 0 0 0 62 69 1 1 0 0 0 69 70 1 0 0 0 0 M END > CFN99147 > Ginsenoside Ro > 34367-04-9 > 98% > C48H76O19 > 957.11 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Ro-CFN99147.html $$$$ -ISIS- 10201511232D 11 11 0 0 0 0 0 0 0 0999 V2000 2.3083 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3083 -5.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.0333 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9250 -5.5708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9250 -4.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -4.1708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1167 -3.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -6.9667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9208 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 6 7 1 0 0 0 0 4 8 1 0 0 0 0 3 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 M END > CFN99160 > DL-Menthol > 15356-70-4 > 98% > C10H20O > 156.27 > White cryst. > Monoterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/DL-Menthol-CFN99160.html $$$$ -ISIS- 10201511232D 23 24 0 0 0 0 0 0 0 0999 V2000 -0.1250 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4375 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4375 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9083 -7.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2167 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9958 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7792 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1208 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4625 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2458 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2458 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4625 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0208 -7.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7792 -4.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -4.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 18 21 1 0 0 0 0 10 22 2 0 0 0 0 12 23 2 0 0 0 0 M END > CFN99186 > Bisdemethoxycurcumin > 33171-05-0 > 98% > C19H16O4 > 308.33 > Yellow powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Bisdemethoxycurcumin-CFN99186.html $$$$ -ISIS- 10201511232D 13 13 0 0 0 0 0 0 0 0999 V2000 4.1375 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1375 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -8.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6833 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6833 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2250 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7708 -7.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -6.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -8.6375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -5.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 9 13 2 0 0 0 0 M END > CFN99190 > Caffeic acid > 331-39-5 > 98% > C9H8O4 > 180.15 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Caffeic-acid-CFN99190.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 2.2458 -6.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7667 -7.6125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2875 -7.3125 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2875 -6.7125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7667 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -7.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -6.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -6.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8458 -5.8125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3250 -5.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -5.5125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8833 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -5.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2875 -6.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -7.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -7.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -4.9125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8458 -4.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -4.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4042 -4.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -4.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -4.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9625 -4.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -5.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -4.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9625 -5.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4667 -8.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0667 -8.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 2 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 2 20 2 0 0 0 0 11 21 1 6 0 0 0 15 22 1 1 0 0 0 22 23 1 6 0 0 0 24 22 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 27 26 2 0 0 0 0 28 27 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 3 32 1 1 0 0 0 3 33 1 6 0 0 0 M END > CFN99244 > Ganoderiol F > 114567-47-4 > 98% > C30H46O3 > 454.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderiol-F-CFN99244.html $$$$ -ISIS- 10201511232D 22 24 0 0 0 0 0 0 0 0999 V2000 3.9917 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9917 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2667 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2667 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -6.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9042 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7208 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7208 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9042 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5417 -5.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -9.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -9.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -6.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -8.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5417 -7.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 13 22 1 0 0 0 0 M END > CFN99272 > Quercetin > 117-39-5 > 98% > C15H10O7 > 302.2 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Quercetin-CFN99272.html $$$$ -ISIS- 10201511232D 22 24 0 0 0 0 0 0 0 0999 V2000 3.9917 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9917 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2667 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2667 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -6.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9042 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7208 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7208 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9042 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5417 -5.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -9.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -9.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -6.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -8.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5417 -7.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 13 22 1 0 0 0 0 M END > CFN99272 > Quercetin > 117-39-5 > 98% > C15H10O7 > 302.2 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Quercetin-CFN99272.html $$$$ -ISIS- 10201511232D 22 24 0 0 0 0 0 0 0 0999 V2000 3.9917 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9917 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2667 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2667 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -6.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9042 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7208 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7208 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9042 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5417 -5.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -9.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -9.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -6.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -8.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5417 -7.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 13 22 1 0 0 0 0 M END > CFN99272 > Quercetin > 117-39-5 > 98% > C15H10O7 > 302.2 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Quercetin-CFN99272.html $$$$ -ISIS- 10201511232D 22 24 0 0 0 0 0 0 0 0999 V2000 3.9917 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9917 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -8.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2667 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2667 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -6.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9042 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7208 -6.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7208 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9042 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5417 -5.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -9.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -9.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -6.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -8.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5417 -7.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 8 21 1 0 0 0 0 13 22 1 0 0 0 0 M END > CFN99272 > Quercetin > 117-39-5 > 98% > C15H10O7 > 302.2 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Quercetin-CFN99272.html $$$$ -ISIS- 10201511232D 15 16 0 0 0 0 0 0 0 0999 V2000 4.9917 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -5.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3625 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 M END > CFN99314 > Scoparone > 120-08-1 > 98% > C11H10O4 > 206.2 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Scoparone-CFN99314.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 4.3583 -4.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3583 -5.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 -6.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 -5.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 -4.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 -4.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 -7.0958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5125 -6.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 -3.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3583 -2.7000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 -2.7000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5125 -7.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 3 7 1 0 0 0 0 2 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 8 12 1 0 0 0 0 M END > CFN99331 > Vanillic acid > 121-34-6 > 98% > C8H8O4 > 168.2 > Powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Vanillic-acid-CFN99331.html $$$$ -ISIS- 10201511232D 45 49 0 0 0 0 0 0 0 0999 V2000 4.1792 -5.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1792 -6.5458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7000 -6.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -6.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -5.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7000 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -6.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -5.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -5.6458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7792 -5.6458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7792 -5.0458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2583 -4.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -5.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -4.7458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8167 -5.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -4.1458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7792 -3.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 -3.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3375 -4.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8583 -3.8458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3750 -4.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8958 -3.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8583 -3.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 -4.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 -2.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7792 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -5.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6625 -6.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.2458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7792 -6.2458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -5.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -5.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1417 -7.1458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6208 -6.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -7.1458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1000 -7.7458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6208 -8.0458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1417 -7.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6208 -8.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 -6.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6625 -8.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 -8.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0625 -7.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 11 1 0 0 0 0 18 19 1 6 0 0 0 20 18 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 23 26 2 0 0 0 0 25 27 1 0 0 0 0 12 28 1 1 0 0 0 5 29 1 1 0 0 0 2 30 1 1 0 0 0 10 31 1 6 0 0 0 11 32 1 6 0 0 0 9 33 1 1 0 0 0 15 34 1 6 0 0 0 18 15 1 0 0 0 0 22 25 1 6 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 35 1 0 0 0 0 35 30 1 1 0 0 0 39 41 1 1 0 0 0 37 42 1 1 0 0 0 40 43 1 6 0 0 0 38 44 1 6 0 0 0 42 45 1 0 0 0 0 M END > CFN99351 > Clerosterol glucoside > 123621-00-1 > 98% > C35H58O6 > 574.8 > Powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Clerosterol-glucoside-CFN99351.html $$$$ -ISIS- 10201511232D 34 38 0 0 0 0 0 0 0 0999 V2000 3.9292 -7.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9292 -8.3500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7208 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5167 -8.3500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5167 -7.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7208 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1042 -8.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1042 -7.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3083 -6.9792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8958 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -6.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1042 -5.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -6.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -7.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4833 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4833 -6.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6917 -5.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1375 -8.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -9.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5167 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1042 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2833 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -9.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2833 -5.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2833 -4.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4833 -4.2250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6917 -4.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5167 -9.2708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -7.8917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -5.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -6.5167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0250 -3.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9417 -3.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 2 19 1 1 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 18 1 0 0 0 0 4 29 1 6 0 0 0 10 30 1 6 0 0 0 12 31 1 6 0 0 0 18 32 1 1 0 0 0 27 33 1 1 0 0 0 27 34 1 6 0 0 0 M END > CFN99381 > Taraxerol > 127-22-0 > 98% > C30H50O > 426.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Taraxerol-CFN99381.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 3.0875 -3.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0875 -4.1750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8750 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6625 -4.1750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6625 -3.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 -4.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -5.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -4.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -1.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 -1.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0875 -1.4458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 1 0 0 0 3 8 1 6 0 0 0 2 9 1 6 0 0 0 6 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 M END > CFN99436 > Shikimic acid > 138-59-0 > 98% > C7H10O5 > 174.2 > Powder > Miscellaneous > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Shikimic-acid-CFN99436.html $$$$ -ISIS- 10201511232D 36 39 0 0 0 0 0 0 0 0999 V2000 0.6917 -4.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6917 -4.9792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2125 -5.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7333 -4.9792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7333 -4.3792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2125 -4.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 -5.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7708 -4.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7708 -4.3792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2542 -4.0792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2917 -4.0792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2917 -3.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7708 -3.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 -3.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -5.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9125 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7333 -3.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7708 -3.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2917 -4.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5125 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7333 -5.5792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 -4.6792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2917 -2.8792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8125 -3.1792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3292 -3.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3292 -4.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8125 -2.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3292 -2.8792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2917 -2.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3292 -2.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -2.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3708 -2.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -2.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4083 -2.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -3.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8125 -1.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 3 16 1 1 0 0 0 5 17 1 1 0 0 0 9 18 1 1 0 0 0 11 19 1 6 0 0 0 3 20 1 6 0 0 0 4 21 1 6 0 0 0 10 22 1 6 0 0 0 12 23 1 1 0 0 0 24 12 1 0 0 0 0 25 24 1 0 0 0 0 25 26 1 0 0 0 0 11 26 1 0 0 0 0 24 28 1 6 0 0 0 27 29 1 6 0 0 0 30 27 1 0 0 0 0 31 30 1 0 0 0 0 32 31 1 0 0 0 0 33 32 2 0 0 0 0 34 33 1 0 0 0 0 33 35 1 0 0 0 0 27 36 1 1 0 0 0 27 24 1 0 0 0 0 2 15 1 1 0 0 0 M END > CFN99476 > Dammarenediol II > 14351-29-2 > 98% > C30H52O2 > 444.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Dammarenediol-II-CFN99476.html $$$$ -ISIS- 10201511232D 29 31 0 0 0 0 0 0 0 0999 V2000 3.2667 -5.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2667 -6.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -6.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8583 -6.4417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2500 -5.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8583 -4.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -4.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3833 -6.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9917 -7.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3833 -7.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2667 -8.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -7.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8417 -3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2917 -3.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -4.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 -7.1500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5333 -6.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9375 -7.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8625 -2.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0208 -2.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4458 -3.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7167 -5.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8417 -5.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6625 -4.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4708 -8.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8208 -8.6208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9167 -8.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 1 2 0 0 0 0 2 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 3 2 0 0 0 0 7 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 1 1 0 0 0 0 4 17 1 6 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 14 21 1 0 0 0 0 21 22 1 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 24 25 1 0 0 0 0 23 26 1 0 0 0 0 11 27 2 0 0 0 0 10 28 1 0 0 0 0 28 29 1 0 0 0 0 M END > CFN99514 > Colchicine > 64-86-8 > 98% > C22H25NO6 > 399.44 > Powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Colchicine-CFN99514.html $$$$ -ISIS- 10201511232D 20 20 0 0 0 0 0 0 0 0999 V2000 0.0833 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0833 -2.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8792 -3.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -2.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8792 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4667 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2625 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -1.1958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -0.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -3.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -0.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4375 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2333 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6125 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 1 10 1 0 0 0 0 10 11 1 0 0 0 0 2 12 1 0 0 0 0 9 13 1 0 0 0 0 9 14 2 0 0 0 0 13 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 M END > CFN99531 > 6-Shogaol > 555-66-8 > 98% > C17H24O3 > 276.37 > Oil > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/6-Shogaol-CFN99531.html $$$$ -ISIS- 10201511232D 27 28 0 0 0 0 0 0 0 0999 V2000 -0.1250 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4375 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4375 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9083 -7.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2167 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9958 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7792 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5583 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1208 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4625 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2458 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2458 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4625 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0208 -7.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7792 -4.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -4.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0167 -5.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9042 -5.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6833 -5.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7958 -5.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 18 21 1 0 0 0 0 10 22 2 0 0 0 0 12 23 2 0 0 0 0 19 24 1 0 0 0 0 1 25 1 0 0 0 0 25 26 1 0 0 0 0 24 27 1 0 0 0 0 M END > CFN99540 > Dihydrocurcumin > 76474-56-1 > 98% > C21H22O6 > 370.40 > Powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Dihydrocurcumin-CFN99540.html $$$$ -ISIS- 10201511232D 8 7 0 0 0 0 0 0 0 0999 V2000 1.9083 -6.3458 0.0000 N 0 3 3 0 0 0 0 0 0 0 0 0 2.7000 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2917 -5.8875 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4958 -7.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -6.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3667 -7.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4458 -5.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 M CHG 2 1 1 4 -1 M END > CFN99546 > Betaine > 107-43-7 > 98% > C5H11NO2 > 117.15 > White cryst. > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Betaine-CFN99546.html $$$$ -ISIS- 10201511232D 9 7 0 0 0 0 0 0 0 0999 V2000 1.9083 -6.3458 0.0000 N 0 3 3 0 0 0 0 0 0 0 0 0 2.7000 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2917 -5.8875 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4958 -7.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -6.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3667 -7.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4458 -5.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.7750 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 M CHG 2 1 1 4 -1 M END > CFN99547 > Betaine hydrochloride > 590-46-5 > 98% > C5H12ClNO2 > 153.60 > White cryst. > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Betaine-hydrochloride-CFN99547.html $$$$ -ISIS- 10201511232D 19 20 0 0 0 0 0 0 0 0999 V2000 4.7208 -6.7333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7208 -7.6583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5208 -8.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3208 -7.6583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3208 -6.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5208 -6.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9292 -6.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1125 -6.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5208 -9.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9292 -8.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1125 -8.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -6.7333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9125 -5.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7125 -6.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5083 -5.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5083 -4.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7125 -4.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9125 -4.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3083 -4.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 1 7 1 1 0 0 0 5 8 1 1 0 0 0 3 9 1 1 0 0 0 2 10 1 6 0 0 0 4 11 1 6 0 0 0 7 12 1 0 0 0 0 8 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 13 1 0 0 0 0 16 19 1 0 0 0 0 M END > CFN99550 > Arbutin > 497-76-7 > 98% > C12H16O7 > 272.26 > White powder > Phenols > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Arbutin-CFN99550.html $$$$ -ISIS- 10201511232D 45 50 0 0 0 0 0 0 0 0999 V2000 0.3125 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -2.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -0.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -2.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5000 -1.7083 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.5000 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -0.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -2.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -0.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -3.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -3.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -4.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -5.8500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3125 -6.3125 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 0.3125 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -7.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -2.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -5.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -7.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -5.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -5.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -7.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 1 6 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 12 15 1 0 0 0 0 11 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 16 1 0 0 0 0 15 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 15 1 0 0 0 0 22 27 1 0 0 0 0 25 28 1 0 0 0 0 19 29 1 0 0 0 0 29 30 1 0 0 0 0 28 31 1 6 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 31 1 0 0 0 0 8 37 1 0 0 0 0 32 38 1 0 0 0 0 35 39 1 0 0 0 0 39 40 2 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 42 36 1 0 0 0 0 41 43 1 0 0 0 0 40 44 1 0 0 0 0 44 45 1 0 0 0 0 M END > CFN99574 > Isoliensinine > 6817-41-0 > 98% > C37H42N2O6 > 610.75 > White powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Isoliensinine-CFN99574.html $$$$ -ISIS- 10201511232D 50 54 0 0 0 0 0 0 0 0999 V2000 0.3125 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -2.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -0.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -2.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5000 -1.7083 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.5000 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -0.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -2.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -0.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -3.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -3.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -4.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -5.8500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3125 -6.3125 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 0.3125 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -7.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -2.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -5.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -7.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -5.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -5.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -7.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -1.8750 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -2.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -0.9542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3917 -1.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2333 -1.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 1 6 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 12 15 1 0 0 0 0 11 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 16 1 0 0 0 0 15 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 15 1 0 0 0 0 22 27 1 0 0 0 0 25 28 1 0 0 0 0 19 29 1 0 0 0 0 28 30 1 6 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 35 30 1 0 0 0 0 8 36 1 0 0 0 0 31 37 1 0 0 0 0 34 38 1 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 41 35 1 0 0 0 0 40 42 1 0 0 0 0 42 43 1 0 0 0 0 39 44 1 0 0 0 0 44 45 1 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 46 47 2 0 0 0 0 46 48 2 0 0 0 0 46 49 2 0 0 0 0 46 50 1 0 0 0 0 M END > CFN99578 > Liensinine perchlorate > 2385-63-9 > 98% > C37H42N2O6.ClHO4 > 711.20 > White powder > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Liensinine-perchlorate-CFN99578.html $$$$ -ISIS- 10201511232D 55 58 0 0 0 0 0 0 0 0999 V2000 0.3125 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -2.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -0.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -2.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5000 -1.7083 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.5000 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -0.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -2.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -0.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -3.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -3.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -4.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -5.8500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3125 -6.3125 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 0.3125 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -7.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -2.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -5.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -7.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -5.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -5.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -7.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -1.8750 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -2.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -0.9542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3917 -1.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2333 -1.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -6.7167 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -7.6375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0917 -5.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0125 -6.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -6.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 1 6 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 12 15 1 0 0 0 0 11 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 16 1 0 0 0 0 15 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 15 1 0 0 0 0 22 27 1 0 0 0 0 25 28 1 0 0 0 0 19 29 1 0 0 0 0 28 30 1 6 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 35 30 1 0 0 0 0 8 36 1 0 0 0 0 31 37 1 0 0 0 0 34 38 1 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 41 35 1 0 0 0 0 40 42 1 0 0 0 0 42 43 1 0 0 0 0 39 44 1 0 0 0 0 44 45 1 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 46 47 2 0 0 0 0 46 48 2 0 0 0 0 46 49 2 0 0 0 0 46 50 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 51 52 2 0 0 0 0 51 53 2 0 0 0 0 51 54 2 0 0 0 0 51 55 1 0 0 0 0 M END > CFN99579 > Liensinine diperchlorate > 5088-90-4 > 98% > C37H42N2O6.(HClO4)2 > 811.67 > White powder > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Liensinine-diperchlorate-CFN99579.html $$$$ -ISIS- 10201511232D 45 50 0 0 0 0 0 0 0 0999 V2000 0.3125 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -2.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -0.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -2.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5000 -1.7083 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.5000 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -0.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -2.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -0.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -3.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -3.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -4.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -5.8500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3125 -6.3125 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 0.3125 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -7.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -2.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -5.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -7.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -5.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -5.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -7.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 1 6 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 12 15 1 0 0 0 0 11 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 16 1 0 0 0 0 15 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 15 1 0 0 0 0 22 27 1 0 0 0 0 25 28 1 0 0 0 0 19 29 1 0 0 0 0 28 30 1 6 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 35 30 1 0 0 0 0 8 36 1 0 0 0 0 31 37 1 0 0 0 0 34 38 1 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 41 35 1 0 0 0 0 40 42 1 0 0 0 0 42 43 1 0 0 0 0 39 44 1 0 0 0 0 44 45 1 0 0 0 0 M END > CFN99580 > Liensinine > 2586-96-1 > 98% > C37H42N2O6 > 610.75 > White powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Liensinine-CFN99580.html $$$$ -ISIS- 10201511232D 46 51 0 0 0 0 0 0 0 0999 V2000 0.3125 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -2.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -0.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -2.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5000 -1.7083 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.5000 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -0.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -2.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -0.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -3.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -3.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -4.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -4.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -4.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -5.8500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3125 -6.3125 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 0.3125 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1083 -7.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -2.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -5.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -7.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 -5.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -5.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2958 -7.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 -7.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 1 6 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 12 15 1 0 0 0 0 11 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 16 1 0 0 0 0 15 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 15 1 0 0 0 0 22 27 1 0 0 0 0 25 28 1 0 0 0 0 19 29 1 0 0 0 0 29 30 1 0 0 0 0 28 31 1 6 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 31 1 0 0 0 0 8 37 1 0 0 0 0 32 38 1 0 0 0 0 35 39 1 0 0 0 0 39 40 2 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 42 36 1 0 0 0 0 41 43 1 0 0 0 0 43 44 1 0 0 0 0 40 45 1 0 0 0 0 45 46 1 0 0 0 0 M END > CFN99581 > Neferine > 2292-16-2 > 98% > C38H44N2O6 > 624.77 > White powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Neferine-CFN99581.html $$$$ -ISIS- 10201511232D 11 10 0 0 0 0 0 0 0 0999 V2000 4.7458 -4.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5667 -5.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3875 -4.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2083 -5.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0292 -4.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8500 -5.3500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6667 -4.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4875 -5.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3750 -6.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3208 -6.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5667 -6.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 2 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 7 6 1 0 0 0 0 7 8 2 0 0 0 0 6 9 1 1 0 0 0 6 10 1 6 0 0 0 2 11 1 0 0 0 0 M END > CFN99582 > Linalool > 78-70-6 > 98% > C10H18O > 154.25 > Oil > Monoterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Linalool-CFN99582.html $$$$ -ISIS- 10201511232D 44 48 0 0 0 0 0 0 0 0999 V2000 4.9083 -14.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -15.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -15.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -15.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -14.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -13.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2292 -15.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0042 -15.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0042 -14.2917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2292 -13.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7833 -13.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -14.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 -13.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 -12.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -12.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7833 -12.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -16.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0958 -12.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2292 -16.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -13.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -12.9583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9083 -12.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -11.6167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1417 -11.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3667 -11.6167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3667 -12.5083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5917 -12.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5917 -11.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -10.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -11.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -11.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2292 -11.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0042 -11.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7833 -11.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7833 -10.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0042 -9.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2292 -10.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4542 -9.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0042 -8.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -9.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -11.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8708 -12.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1000 -14.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9125 -16.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 3 17 1 0 0 0 0 14 18 1 0 0 0 0 7 19 2 0 0 0 0 1 20 1 0 0 0 0 21 20 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 26 27 1 6 0 0 0 25 28 1 1 0 0 0 24 29 1 6 0 0 0 23 30 1 1 0 0 0 30 31 1 0 0 0 0 32 31 1 1 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 32 1 0 0 0 0 37 38 1 6 0 0 0 36 39 1 6 0 0 0 35 40 1 1 0 0 0 34 41 1 6 0 0 0 9 11 1 6 0 0 0 18 42 1 0 0 0 0 13 43 1 0 0 0 0 17 44 1 0 0 0 0 M END > CFN99584 > Methyl hesperidin > 11013-97-1 > 98% > C29H36O15 > 624.59 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Methyl-hesperidin-CFN99584.html $$$$ -ISIS- 10201511232D 27 29 0 0 0 0 0 0 0 0999 V2000 2.7667 -4.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7667 -5.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5458 -5.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -5.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -4.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5458 -3.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -5.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -5.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -4.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6625 -3.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -4.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2208 -3.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2208 -3.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -2.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6625 -3.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -6.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5458 -6.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -2.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9875 -5.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2083 -5.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9875 -3.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7833 -3.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2083 -4.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7667 -7.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -4.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7833 -3.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 7 17 2 0 0 0 0 3 18 1 0 0 0 0 14 19 1 0 0 0 0 2 20 1 0 0 0 0 20 21 1 0 0 0 0 1 22 1 0 0 0 0 19 23 1 0 0 0 0 22 24 1 0 0 0 0 18 25 1 0 0 0 0 13 26 1 0 0 0 0 26 27 1 0 0 0 0 M END > CFN99599 > Sinensetin > 2306-27-6 > 98% > C20H20O7 > 372.37 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sinensetin-CFN99599.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 4.9750 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -8.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -8.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6458 -8.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6458 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -6.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -6.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6458 -5.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -9.8667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -8.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -5.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 3 9 1 0 0 0 0 2 10 1 0 0 0 0 4 11 1 0 0 0 0 7 12 2 0 0 0 0 M END > CFN99624 > Gallic acid > 149-91-7 > 98% > C7H6O5 > 170.1 > Powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Gallic-acid-CFN99624.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 4.9750 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -8.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -8.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6458 -8.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6458 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -6.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -6.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6458 -5.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -9.8667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -8.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -5.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 3 9 1 0 0 0 0 2 10 1 0 0 0 0 4 11 1 0 0 0 0 7 12 2 0 0 0 0 M END > CFN99624 > Gallic acid > 149-91-7 > 98% > C7H6O5 > 170.1 > Powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Gallic-acid-CFN99624.html $$$$ -ISIS- 10201511232D 21 20 0 0 0 0 0 0 0 0999 V2000 -3.2542 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -5.0417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6958 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9167 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6292 -5.0417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4083 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1833 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7333 -5.0417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5083 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2875 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6292 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7333 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0667 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8375 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6125 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8375 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3875 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1667 -5.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 1 0 0 0 0 2 13 1 0 0 0 0 6 14 1 1 0 0 0 10 15 1 1 0 0 0 16 12 1 0 0 0 0 17 16 1 0 0 0 0 18 17 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 M END > CFN99630 > Phytol > 150-86-7 > 98% > C20H40O > 296.5 > Oil > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Phytol-CFN99630.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 4.3000 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -7.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9083 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9083 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -5.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7125 -5.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5167 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3250 -5.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -5.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -7.8208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6875 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3250 -5.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 11 13 1 0 0 0 0 9 14 2 0 0 0 0 M END > CFN99702 > Zingerone > 122-48-5 > 98% > C11H14O3 > 194.23 > Powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Zingerone-CFN99702.html $$$$ -ISIS- 10201511232D 18 17 0 0 0 0 0 0 0 0999 V2000 6.7208 -6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9167 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1125 -6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5042 -6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8958 -6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8958 -7.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -8.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5042 -7.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 -8.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1125 -7.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9167 -8.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7208 -7.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5208 -8.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3250 -7.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5208 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5208 -9.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 1 17 1 0 0 0 0 15 18 2 0 0 0 0 M END > CFN99716 > Palmitic acid > 57-10-3 > 98% > C16H32O2 > 256.42 > White cryst. > Miscellaneous > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Palmitic-acid-CFN99716.html $$$$ -ISIS- 10201511232D 42 46 0 0 0 0 0 0 0 0999 V2000 4.9083 -14.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -15.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -15.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -15.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -14.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -13.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2292 -15.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0042 -15.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0042 -14.2917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2292 -13.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7833 -13.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -14.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 -13.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 -12.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -12.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7833 -12.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -16.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0958 -12.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2292 -16.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -13.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -12.9583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9083 -12.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -11.6167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1417 -11.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3667 -11.6167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3667 -12.5083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5917 -12.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5917 -11.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -10.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -11.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -11.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2292 -11.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0042 -11.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7833 -11.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7833 -10.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0042 -9.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2292 -10.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4542 -9.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0042 -8.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -9.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -11.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1000 -14.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 3 17 1 0 0 0 0 14 18 1 0 0 0 0 7 19 2 0 0 0 0 1 20 1 0 0 0 0 21 20 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 26 27 1 6 0 0 0 25 28 1 1 0 0 0 24 29 1 6 0 0 0 23 30 1 1 0 0 0 30 31 1 0 0 0 0 32 31 1 1 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 32 1 0 0 0 0 37 38 1 6 0 0 0 36 39 1 6 0 0 0 35 40 1 1 0 0 0 34 41 1 6 0 0 0 9 11 1 6 0 0 0 13 42 1 0 0 0 0 M END > CFN99718 > Eriocitrin > 13463-28-0 > 98% > C27H32O15 > 596.53 > Powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Eriocitrin-CFN99718.html $$$$ -ISIS- 10201511232D 21 23 0 0 0 0 0 0 0 0999 V2000 3.9500 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -8.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2792 -8.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0542 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0542 -6.9625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2792 -6.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2792 -9.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8333 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3875 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3875 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -5.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8333 -5.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -9.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1708 -6.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1625 -5.1708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -4.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 12 1 0 0 0 0 3 18 1 0 0 0 0 1 19 1 0 0 0 0 15 20 1 0 0 0 0 16 21 1 0 0 0 0 9 12 1 6 0 0 0 M END > CFN99719 > Eriodictyol > 552-58-9 > 98% > C15H12O6 > 288.25 > Powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Eriodictyol-CFN99719.html $$$$ -ISIS- 10201511232D 33 35 0 0 0 0 0 0 0 0999 V2000 7.7625 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -8.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -9.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -9.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -8.0958 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 11.7208 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -8.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -6.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7208 -7.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5125 -5.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0958 -6.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -8.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -10.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -9.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -10.8417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9292 -11.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7250 -12.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5167 -12.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5167 -11.3000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3042 -12.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -13.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3042 -10.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -12.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1375 -13.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -6.9542 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 15 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 8 21 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 26 28 1 1 0 0 0 25 29 1 6 0 0 0 27 30 1 6 0 0 0 24 31 1 1 0 0 0 31 32 1 0 0 0 0 M CHG 2 10 1 33 -1 M END > CFN99740 > Cyanidin-3-O-glucoside chloride > 7084-24-4 > 98% > C21H21O11 > 449.38 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Cyanidin-3-O-glucoside-chloride-CFN99740.html $$$$ -ISIS- 10201511232D 44 48 0 0 0 0 0 0 0 0999 V2000 3.9708 -6.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9708 -7.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7667 -7.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5708 -7.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5708 -6.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7667 -5.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 -7.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1708 -7.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1708 -6.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 -5.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -5.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7792 -6.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5833 -5.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5833 -4.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7792 -4.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -4.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3792 -4.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -7.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 -8.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7667 -8.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1667 -5.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -8.4750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1708 -8.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1708 -9.8625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9750 -10.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7792 -9.8625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7792 -8.9375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5833 -10.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 -10.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5833 -8.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -11.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7792 -3.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -9.8667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5833 -2.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3875 -8.9375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3875 -9.8625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1875 -10.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.9875 -9.8625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.9875 -8.9375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1875 -8.4750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1875 -11.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1875 -7.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7917 -8.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7917 -10.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 8 18 1 0 0 0 0 7 19 2 0 0 0 0 3 20 1 0 0 0 0 1 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 22 18 1 1 0 0 0 26 28 1 1 0 0 0 24 29 1 1 0 0 0 27 30 1 6 0 0 0 25 31 1 6 0 0 0 15 32 1 0 0 0 0 29 33 1 0 0 0 0 32 34 1 0 0 0 0 35 30 1 1 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 35 1 0 0 0 0 37 41 1 6 0 0 0 40 42 1 6 0 0 0 39 43 1 6 0 0 0 38 44 1 1 0 0 0 M END > CFN99744 > Isorhamnetin-3-O-neohespeidoside > 55033-90-4 > 98% > C28H32O16 > 624.54 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Isorhamnetin-3-O-neohespeidoside-CFN99744.html $$$$ -ISIS- 10201511232D 27 28 0 0 0 0 0 0 0 0999 V2000 7.2167 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2167 -6.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0208 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0208 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6125 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4125 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 -7.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 -8.3417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4250 -5.5792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -8.8000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2167 -8.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 -8.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 -7.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0417 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2417 -7.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2417 -8.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0417 -8.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -6.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -8.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -8.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -9.7208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4125 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 -8.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 2 9 1 0 0 0 0 1 11 1 0 0 0 0 11 12 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 18 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 10 9 1 1 0 0 0 13 24 1 6 0 0 0 8 25 2 0 0 0 0 3 26 1 0 0 0 0 26 27 1 0 0 0 0 M END > CFN99752 > Myrislignan > 171485-39-5 > 98% > C21H26O6 > 374.43 > White powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Myrislignan-CFN99752.html $$$$ -ISIS- 10201511232D 49 53 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -1.6167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -1.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -1.1667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -1.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 20 36 1 1 0 0 0 15 37 1 6 0 0 0 38 36 1 1 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 38 1 0 0 0 0 42 44 1 1 0 0 0 40 45 1 1 0 0 0 45 46 1 0 0 0 0 41 47 1 6 0 0 0 43 48 1 6 0 0 0 7 49 1 6 0 0 0 M END > CFN99754 > Ginsenoside F1 > 53963-43-2 > 98% > C36H62O9 > 638.88 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-F1-CFN99754.html $$$$ -ISIS- 10201511232D 59 64 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 -7.0292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2458 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6833 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6833 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4667 -7.4792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4667 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -5.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -4.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -1.6167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -1.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -1.1667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -1.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 20 47 1 1 0 0 0 15 48 1 6 0 0 0 49 47 1 1 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 49 1 0 0 0 0 53 55 1 1 0 0 0 51 56 1 1 0 0 0 56 57 1 0 0 0 0 52 58 1 6 0 0 0 54 59 1 6 0 0 0 M END > CFN99755 > Ginsenoside F2 > 62025-49-4 > 98% > C42H72O13 > 785.01 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-F2-CFN99755.html $$$$ -ISIS- 10201511232D 48 52 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -1.6167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -1.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -1.1667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -1.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 20 36 1 1 0 0 0 15 37 1 6 0 0 0 38 36 1 1 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 38 1 0 0 0 0 42 44 1 1 0 0 0 40 45 1 1 0 0 0 45 46 1 0 0 0 0 41 47 1 6 0 0 0 43 48 1 6 0 0 0 M END > CFN99756 > Ginsenoside Compound K > 39262-14-1 > 98% > C36H62O8 > 622.88 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Compound-K-CFN99756.html $$$$ -ISIS- 10201511232D 37 40 0 0 0 0 0 0 0 0999 V2000 1.2000 -5.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -6.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9875 -7.0750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7750 -6.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7750 -5.7125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9875 -5.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5625 -7.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -6.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -5.7125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5625 -5.2583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1375 -5.2583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1375 -4.3500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3500 -3.8958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5625 -4.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 -7.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5333 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -4.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -4.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -6.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4417 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -7.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5625 -6.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -3.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -3.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7083 -4.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -5.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -2.9875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7083 -3.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2833 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0708 -2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8583 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0708 -3.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -2.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -2.9875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 3 16 1 1 0 0 0 5 17 1 1 0 0 0 9 18 1 1 0 0 0 11 19 1 6 0 0 0 3 20 1 6 0 0 0 4 21 1 6 0 0 0 10 22 1 6 0 0 0 12 23 1 1 0 0 0 24 12 1 0 0 0 0 25 24 1 0 0 0 0 25 26 1 0 0 0 0 11 26 1 0 0 0 0 24 28 1 6 0 0 0 27 29 1 6 0 0 0 30 27 1 0 0 0 0 31 30 1 0 0 0 0 32 31 1 0 0 0 0 33 32 2 0 0 0 0 34 33 1 0 0 0 0 33 35 1 0 0 0 0 27 36 1 1 0 0 0 27 24 1 0 0 0 0 2 15 1 1 0 0 0 13 37 1 1 0 0 0 M END > CFN99764 > (20S)-Protopanaxdiol > 30636-90-9 > 98% > C30H52O3 > 460.00 > White powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Protopanaxdiol-CFN99764.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 -0.7417 -3.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7417 -4.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0292 -5.0833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8042 -4.6333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8042 -3.7417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0292 -3.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5792 -5.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3542 -4.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3542 -3.7417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5792 -3.2917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1292 -3.2917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1292 -2.4000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3542 -1.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5792 -2.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -3.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6792 -3.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6792 -2.4000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9042 -1.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0292 -5.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -5.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5792 -4.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -4.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6792 -1.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4542 -1.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2292 -2.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0042 -1.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7792 -2.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7792 -3.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -1.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5167 -5.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -2.8458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3542 -2.8458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -1.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 4 20 1 1 0 0 0 10 21 1 1 0 0 0 11 22 1 1 0 0 0 17 23 1 1 0 0 0 17 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 2 30 2 0 0 0 0 5 31 1 6 0 0 0 9 32 1 6 0 0 0 12 33 1 6 0 0 0 M END > CFN99784 > Shionone > 10376-48-4 > 98% > C30H50O > 426.72 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Shionone-CFN99784.html $$$$ -ISIS- 10201511232D 29 34 0 0 0 0 0 0 0 0999 V2000 1.3000 -8.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -8.3917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8458 -8.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6208 -8.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -7.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6208 -7.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0750 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6208 -6.6042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3958 -6.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9458 -6.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9458 -5.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -4.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -5.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1792 -7.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5167 -7.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7958 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3208 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7958 -4.9875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -8.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -7.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -7.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -7.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -8.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -8.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -7.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -8.6667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 2 5 1 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 6 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 10 1 0 0 0 0 9 10 1 6 0 0 0 2 1 1 6 0 0 0 5 16 1 6 0 0 0 6 17 1 6 0 0 0 12 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 13 1 0 0 0 0 1 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 21 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 25 1 0 0 0 0 M END > CFN99799 > Sesamolin > 526-07-8 > 98% > C20H18O7 > 370.36 > White powder > Lignans > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sesamolin-CFN99799.html $$$$ -ISIS- 10201511232D 34 37 0 0 0 0 0 0 0 0999 V2000 -2.2250 -10.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -11.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4292 -12.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6292 -11.6708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6292 -10.7458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4292 -10.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1708 -12.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9667 -11.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9667 -10.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1708 -10.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7667 -10.2875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7667 -9.3625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9667 -8.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1708 -9.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6458 -10.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1875 -9.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6458 -9.0792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0208 -12.1292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9292 -8.2042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3125 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8292 -8.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -8.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -8.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9542 -9.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8542 -9.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4708 -9.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1375 -8.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7667 -8.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6292 -9.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8875 -12.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7667 -12.1292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0042 -11.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9667 -12.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6667 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 2 18 2 0 0 0 0 17 19 1 1 0 0 0 19 20 1 6 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 12 28 1 1 0 0 0 5 29 1 1 0 0 0 3 30 1 1 0 0 0 8 31 2 0 0 0 0 11 32 1 6 0 0 0 3 33 1 6 0 0 0 24 34 1 0 0 0 0 M END > CFN99815 > Ganoderic acid DM > 173075-45-1 > 98% > C30H44O4 > 468.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ganoderic-acid-DM-CFN99815.html $$$$ -ISIS- 10201511232D 20 21 0 0 0 0 0 0 0 0999 V2000 4.1833 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1833 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -5.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -5.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -7.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -5.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -7.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8625 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6458 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6458 -5.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8625 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -5.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 9 5 1 0 0 0 0 7 10 2 0 0 0 0 1 11 1 0 0 0 0 3 12 1 0 0 0 0 8 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 9 20 1 0 0 0 0 M END > CFN99890 > Cardamonin > 19309-14-9 > 98% > C16H14O4 > 270.3 > Yellow powder > Chalcones > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Cardamonin-CFN99890.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 3.1250 -9.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -10.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8875 -10.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -10.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -9.1417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8875 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -10.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -10.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -9.1417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4208 -8.7000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9500 -8.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9500 -7.8167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1875 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -7.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -7.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4833 -7.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -6.4917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9500 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0125 -6.0458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7792 -6.4917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5458 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -8.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -10.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -9.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -9.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -8.2583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0125 -5.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 18 19 1 6 0 0 0 20 18 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 23 25 1 0 0 0 0 5 26 1 1 0 0 0 12 27 1 1 0 0 0 2 28 1 1 0 0 0 10 29 1 6 0 0 0 11 30 1 6 0 0 0 15 18 1 1 0 0 0 9 31 1 1 0 0 0 22 32 1 1 0 0 0 32 33 1 0 0 0 0 M END > CFN99916 > Beta-Sitosterol > 83-46-5 > 98% > C29H50O > 414.69 > Cryst. > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sitosterol-CFN99916.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 3.1250 -9.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -10.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8875 -10.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -10.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -9.1417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8875 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -10.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -10.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -9.1417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4208 -8.7000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9500 -8.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9500 -7.8167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1875 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -7.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -7.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4833 -7.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -6.4917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9500 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0125 -6.0458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7792 -6.4917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5458 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -8.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -10.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -9.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -9.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -8.2583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0125 -5.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 18 19 1 6 0 0 0 20 18 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 23 25 1 0 0 0 0 5 26 1 1 0 0 0 12 27 1 1 0 0 0 2 28 1 1 0 0 0 10 29 1 6 0 0 0 11 30 1 6 0 0 0 15 18 1 1 0 0 0 9 31 1 1 0 0 0 22 32 1 1 0 0 0 32 33 1 0 0 0 0 M END > CFN99916 > Beta-Sitosterol > 83-46-5 > 98% > C29H50O > 414.69 > Cryst. > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sitosterol-CFN99916.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 3.1250 -9.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -10.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8875 -10.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -10.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -9.1417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8875 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -10.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -10.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -9.1417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4208 -8.7000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9500 -8.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9500 -7.8167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1875 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -7.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -7.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4833 -7.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -6.4917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9500 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0125 -6.0458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7792 -6.4917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5458 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -8.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -10.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -9.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -9.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -8.2583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0125 -5.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 18 19 1 6 0 0 0 20 18 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 23 25 1 0 0 0 0 5 26 1 1 0 0 0 12 27 1 1 0 0 0 2 28 1 1 0 0 0 10 29 1 6 0 0 0 11 30 1 6 0 0 0 15 18 1 1 0 0 0 9 31 1 1 0 0 0 22 32 1 1 0 0 0 32 33 1 0 0 0 0 M END > CFN99916 > Beta-Sitosterol > 83-46-5 > 98% > C29H50O > 414.69 > Cryst. > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sitosterol-CFN99916.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 3.1250 -9.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -10.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8875 -10.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -10.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -9.1417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8875 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -10.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -10.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -9.1417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4208 -8.7000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9500 -8.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9500 -7.8167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1875 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -7.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -7.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4833 -7.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -6.4917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9500 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0125 -6.0458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7792 -6.4917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5458 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -8.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -10.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -9.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -9.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -8.2583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0125 -5.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 18 19 1 6 0 0 0 20 18 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 23 25 1 0 0 0 0 5 26 1 1 0 0 0 12 27 1 1 0 0 0 2 28 1 1 0 0 0 10 29 1 6 0 0 0 11 30 1 6 0 0 0 15 18 1 1 0 0 0 9 31 1 1 0 0 0 22 32 1 1 0 0 0 32 33 1 0 0 0 0 M END > CFN99916 > Beta-Sitosterol > 83-46-5 > 98% > C29H50O > 414.69 > Cryst. > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sitosterol-CFN99916.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 3.1250 -9.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -10.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8875 -10.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -10.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -9.1417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8875 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -10.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -10.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -9.1417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4208 -8.7000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9500 -8.7000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9500 -7.8167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1875 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -7.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -7.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4833 -7.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -8.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -6.4917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9500 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0125 -6.0458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7792 -6.4917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5458 -6.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -8.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -10.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -9.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -9.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -8.2583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0125 -5.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 18 19 1 6 0 0 0 20 18 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 23 25 1 0 0 0 0 5 26 1 1 0 0 0 12 27 1 1 0 0 0 2 28 1 1 0 0 0 10 29 1 6 0 0 0 11 30 1 6 0 0 0 15 18 1 1 0 0 0 9 31 1 1 0 0 0 22 32 1 1 0 0 0 32 33 1 0 0 0 0 M END > CFN99916 > Beta-Sitosterol > 83-46-5 > 98% > C29H50O > 414.69 > Cryst. > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sitosterol-CFN99916.html $$$$ -ISIS- 10201511232D 22 22 0 0 0 0 0 0 0 0999 V2000 1.1500 -3.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -4.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -4.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6958 -4.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6958 -3.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -2.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3792 -2.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -1.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6958 -1.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -4.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -5.5333 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2333 -5.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2333 -6.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0042 -5.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0042 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0042 -8.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7792 -8.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7792 -9.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -9.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -10.8750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7792 -11.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3208 -11.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 4 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 M END > CFN99917 > Capsaicin > 404-86-4 > 98% > C18H27NO3 > 305.42 > White powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Capsaicin-CFN99917.html $$$$ -ISIS- 10201511232D 22 22 0 0 0 0 0 0 0 0999 V2000 1.1500 -3.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -4.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -4.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6958 -4.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6958 -3.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -2.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3792 -2.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -1.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6958 -1.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -4.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -5.5333 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2333 -5.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2333 -6.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0042 -5.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0042 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0042 -8.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7792 -8.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7792 -9.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -9.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -10.8750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7792 -11.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3208 -11.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 4 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 M END > CFN99918 > Dihydrocapsaicin > 19408-84-5 > 98% > C18H29NO3 > 307.43 > White cryst. > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Dihydrocapsaicin-CFN99918.html $$$$ -ISIS- 10201511232D 21 23 0 0 0 0 0 0 0 0999 V2000 6.1750 -5.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -6.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -7.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -6.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -5.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9708 -5.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6333 -7.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1708 -6.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6333 -5.6333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3833 -5.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5917 -5.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -5.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0083 -5.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2167 -5.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -5.9167 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.2167 -4.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6333 -5.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1625 -5.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1625 -6.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6333 -7.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -6.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 1 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 15 1 0 0 0 0 M END > CFN99919 > Piperine > 94-62-2 > 98% > C17H19NO3 > 285.34 > White powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Piperine-CFN99919.html $$$$ -ISIS- 10201511232D 21 21 0 0 0 0 0 0 0 0999 V2000 0.4250 -4.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -5.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2208 -6.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0167 -5.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0167 -4.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2208 -4.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8125 -4.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6042 -4.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -4.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3667 -4.2250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3667 -3.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3667 -6.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1917 -4.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -3.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -4.2250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7792 -4.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5750 -4.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3708 -4.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1625 -4.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9583 -4.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -3.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 1 10 1 0 0 0 0 10 11 1 0 0 0 0 2 12 1 0 0 0 0 9 13 1 0 0 0 0 9 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 15 21 1 1 0 0 0 M END > CFN99931 > 6-Gingerol > 23513-14-6 > 98% > C17H26O4 > 294.4 > Oil > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/6-Gingerol-CFN99931.html $$$$ -ISIS- 10201511232D 91 99 0 0 0 0 0 0 0 0999 V2000 1.4750 -7.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -8.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1292 -8.9375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7792 -8.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -7.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1292 -7.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -8.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -8.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -7.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4292 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7292 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7292 -6.6833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0792 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -6.6833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4417 -7.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 -7.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -6.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6750 -5.7375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7292 -5.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8292 -8.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -9.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -9.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -7.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -6.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -5.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -5.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6583 -5.9000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1875 -6.4333 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9125 -6.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -7.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7208 -6.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -5.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -7.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5042 -4.8042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1500 -5.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8042 -4.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8042 -4.0542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1500 -3.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5042 -4.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4500 -5.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -2.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1042 -4.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1792 -8.5583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1792 -7.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -7.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1208 -7.8083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1208 -8.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4708 -8.9333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4708 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7708 -8.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7708 -7.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -9.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -6.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -5.5583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4708 -5.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4708 -4.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1208 -4.0583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7708 -4.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7708 -5.1833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1792 -4.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4208 -4.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -3.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4208 -5.5583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1792 -3.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -2.9292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5000 -2.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 -1.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8500 -1.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1958 -1.8042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1958 -2.5542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7500 -5.1792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7458 -5.9333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3958 -6.3125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.0500 -5.9333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.0500 -5.1792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.3958 -4.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -1.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5458 -1.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0958 -6.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7000 -6.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3958 -7.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7000 -4.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -0.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -2.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -0.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3500 -5.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 1 0 0 0 12 19 1 1 0 0 0 10 20 1 1 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 3 23 1 6 0 0 0 5 24 1 6 0 0 0 14 25 1 6 0 0 0 11 26 1 6 0 0 0 18 27 1 6 0 0 0 18 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 1 0 0 0 9 36 1 6 0 0 0 37 35 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 39 43 1 1 0 0 0 41 44 1 1 0 0 0 42 45 1 6 0 0 0 40 46 1 6 0 0 0 43 47 1 0 0 0 0 48 21 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 6 0 0 0 53 57 1 6 0 0 0 54 58 1 0 0 0 0 59 58 1 1 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 59 1 0 0 0 0 61 65 1 1 0 0 0 63 66 1 1 0 0 0 62 67 1 6 0 0 0 64 68 1 6 0 0 0 65 69 1 0 0 0 0 70 45 1 1 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 70 1 0 0 0 0 76 47 1 6 0 0 0 76 77 1 0 0 0 0 77 78 1 0 0 0 0 78 79 1 0 0 0 0 79 80 1 0 0 0 0 80 81 1 0 0 0 0 81 76 1 0 0 0 0 72 82 1 1 0 0 0 74 83 1 1 0 0 0 77 84 1 1 0 0 0 79 85 1 1 0 0 0 78 86 1 6 0 0 0 80 87 1 6 0 0 0 73 88 1 6 0 0 0 75 89 1 6 0 0 0 82 90 1 0 0 0 0 87 91 1 0 0 0 0 M END > CFN99937 > Mogroside V > 88901-36-4 > 98% > C60H102O29 > 1287.44 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Mogroside-CFN99937.html $$$$ -ISIS- 10201511232D 78 88 0 0 0 0 0 0 0 0999 V2000 1.5875 -7.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -8.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3375 -8.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -8.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -7.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3375 -7.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8208 -8.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5667 -8.4958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5667 -7.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8208 -7.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8208 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -5.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3375 -6.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3167 -7.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3167 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5667 -5.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -5.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8208 -9.7833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8458 -8.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8458 -7.2000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0583 -5.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0583 -7.6375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -2.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -3.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5458 -3.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2917 -3.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2917 -2.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5458 -2.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0625 -2.0167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5458 -1.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0625 -3.7333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5667 -11.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5667 -12.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3083 -12.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 -12.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 -11.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3083 -11.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -11.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -12.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3083 -13.7208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9125 -11.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2167 -6.0708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2167 -6.9292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.9583 -7.3583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7083 -6.9292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7083 -6.0708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.9583 -5.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9583 -8.2167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4500 -5.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4750 -5.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4750 -7.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4500 -7.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7333 -6.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 -3.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5792 -2.5625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1333 -12.4042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6167 -10.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4750 -10.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9083 -11.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7625 -11.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1917 -10.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7625 -10.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9083 -10.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1875 -10.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3250 -10.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8958 -10.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3250 -11.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1875 -11.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1292 -9.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9542 -9.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8750 -9.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0458 -9.2000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0458 -10.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1917 -12.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1875 -12.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9083 -12.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9000 -12.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0417 -10.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 6 1 0 0 0 0 9 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 11 2 0 0 0 0 12 17 2 0 0 0 0 7 18 2 0 0 0 0 2 19 1 0 0 0 0 1 20 1 0 0 0 0 15 21 1 0 0 0 0 14 22 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 23 1 0 0 0 0 23 29 1 0 0 0 0 28 30 1 0 0 0 0 24 31 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 37 32 1 0 0 0 0 32 38 1 0 0 0 0 33 39 1 0 0 0 0 34 40 1 0 0 0 0 36 41 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 42 1 0 0 0 0 44 48 1 1 0 0 0 46 49 1 0 0 0 0 42 50 1 1 0 0 0 43 51 1 6 0 0 0 45 52 1 6 0 0 0 50 53 1 0 0 0 0 26 54 1 0 0 0 0 54 55 2 0 0 0 0 54 53 1 0 0 0 0 41 56 2 0 0 0 0 41 51 1 0 0 0 0 25 16 1 0 0 0 0 3 37 1 0 0 0 0 57 58 1 0 0 0 0 58 59 2 0 0 0 0 59 60 1 0 0 0 0 60 61 2 0 0 0 0 61 62 1 0 0 0 0 62 63 2 0 0 0 0 63 58 1 0 0 0 0 57 64 2 0 0 0 0 64 65 1 0 0 0 0 65 66 2 0 0 0 0 66 67 1 0 0 0 0 67 68 2 0 0 0 0 68 57 1 0 0 0 0 63 69 1 0 0 0 0 69 70 2 0 0 0 0 64 71 1 0 0 0 0 71 72 2 0 0 0 0 71 48 1 0 0 0 0 52 69 1 0 0 0 0 61 73 1 0 0 0 0 60 74 1 0 0 0 0 68 75 1 0 0 0 0 59 76 1 0 0 0 0 67 77 1 0 0 0 0 66 78 1 0 0 0 0 M END > CFN99938 > Punicalagin > 65995-63-3 > 98% > C48H28O30 > 1084.72 > Powder > Phenols > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Punicalagin-CFN99938.html $$$$ -ISIS- 10201511232D 60 66 0 0 0 0 0 0 0 0999 V2000 3.1208 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1208 -5.7083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9125 -6.1667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7042 -5.7083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7042 -4.7917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9125 -4.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.1667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -4.7917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5042 -4.3333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0875 -4.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0875 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -2.9625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8833 -2.9625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6750 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6750 -4.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0875 -2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7042 -3.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3708 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7042 -6.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4583 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0875 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -3.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -5.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -6.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -2.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -7.5375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2958 -8.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0917 -8.9167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8833 -8.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8833 -7.5375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0917 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6750 -7.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0917 -9.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -8.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6750 -8.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4708 -7.5417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7125 -10.2875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7125 -11.2042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -11.6625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3000 -11.2042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3000 -10.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -9.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -12.5750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -11.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0917 -11.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8833 -2.0500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8833 -3.8792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7667 -2.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2625 -1.5167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6875 -0.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8333 -1.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2375 -1.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1750 -1.4708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6708 -2.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -0.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0875 -1.4708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 3 20 1 6 0 0 0 4 21 1 6 0 0 0 3 22 1 1 0 0 0 11 23 1 6 0 0 0 9 24 1 1 0 0 0 10 25 1 6 0 0 0 2 26 1 1 0 0 0 13 27 1 1 0 0 0 7 28 1 6 0 0 0 29 28 1 6 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 29 1 0 0 0 0 33 35 1 6 0 0 0 31 36 1 6 0 0 0 30 37 1 1 0 0 0 32 38 1 1 0 0 0 35 39 1 0 0 0 0 40 37 1 6 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 40 1 0 0 0 0 41 46 1 1 0 0 0 43 47 1 6 0 0 0 42 48 1 1 0 0 0 44 49 1 1 0 0 0 15 50 1 0 0 0 0 15 51 1 6 0 0 0 50 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 50 1 0 0 0 0 50 56 1 1 0 0 0 53 57 1 6 0 0 0 57 58 1 0 0 0 0 57 59 1 0 0 0 0 57 60 1 0 0 0 0 M END > CFN99963 > Pseudoginsenoside F11 > 69884-00-0 > 98% > C42H72O14 > 801.01 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Pseudoginsenoside-F11-CFN99963.html $$$$ -ISIS- 10201511232D 81 88 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 -7.0292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2458 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6833 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6833 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4667 -7.4792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4667 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -5.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -4.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8750 -9.7333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -10.1833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6833 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6583 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6583 -10.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -10.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4375 -8.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -1.6167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -1.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -1.1667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -1.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6167 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4000 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1792 0.1875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.1792 1.0875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4000 1.5375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6167 1.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8375 1.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4000 2.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9583 1.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9583 -0.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7375 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 20 47 1 1 0 0 0 15 48 1 6 0 0 0 49 44 1 1 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 49 1 0 0 0 0 51 55 1 1 0 0 0 53 56 1 1 0 0 0 52 57 1 6 0 0 0 54 58 1 6 0 0 0 55 59 1 0 0 0 0 60 47 1 1 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 65 60 1 0 0 0 0 64 66 1 1 0 0 0 62 67 1 1 0 0 0 67 68 1 0 0 0 0 63 69 1 6 0 0 0 65 70 1 6 0 0 0 71 68 1 1 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 76 1 0 0 0 0 76 71 1 0 0 0 0 76 77 1 6 0 0 0 75 78 1 1 0 0 0 74 79 1 6 0 0 0 73 80 1 1 0 0 0 80 81 1 0 0 0 0 M END > CFN99964 > Ginsenoside Rb1 > 41753-43-9 > 98% > C54H92O23 > 1109.29 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rb1-CFN99964.html $$$$ -ISIS- 10201511232D 79 86 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 -7.0292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2458 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6833 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6833 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4667 -7.4792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4667 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -5.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -4.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8750 -9.7333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -10.1833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6833 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6583 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6583 -10.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -10.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4375 -8.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -1.6167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -1.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -1.1667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -1.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6167 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4000 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1792 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1792 1.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.4000 1.5375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6167 1.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8375 1.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4000 2.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9583 1.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 20 47 1 1 0 0 0 15 48 1 6 0 0 0 49 44 1 1 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 49 1 0 0 0 0 51 55 1 1 0 0 0 53 56 1 1 0 0 0 52 57 1 6 0 0 0 54 58 1 6 0 0 0 55 59 1 0 0 0 0 60 47 1 1 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 65 60 1 0 0 0 0 64 66 1 1 0 0 0 62 67 1 1 0 0 0 67 68 1 0 0 0 0 63 69 1 6 0 0 0 65 70 1 6 0 0 0 71 68 1 1 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 76 1 0 0 0 0 76 71 1 0 0 0 0 76 77 1 6 0 0 0 75 78 1 1 0 0 0 74 79 1 1 0 0 0 M END > CFN99965 > Ginsenoside Rb2 > 11021-13-9 > 98% > C53H90O22 > 1079.27 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rb2-CFN99965.html $$$$ -ISIS- 10201511232D 79 86 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 -7.0292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2458 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6833 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6833 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4667 -7.4792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4667 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -5.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -4.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8750 -9.7333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -10.1833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6833 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6583 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6583 -10.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -10.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4375 -8.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -1.6167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -1.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -1.1667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -1.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6167 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4000 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1792 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1792 1.0875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4000 1.5375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6167 1.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8375 1.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4000 2.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9583 1.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 20 47 1 1 0 0 0 15 48 1 6 0 0 0 49 44 1 1 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 49 1 0 0 0 0 51 55 1 1 0 0 0 53 56 1 1 0 0 0 52 57 1 6 0 0 0 54 58 1 6 0 0 0 55 59 1 0 0 0 0 60 47 1 1 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 65 60 1 0 0 0 0 64 66 1 1 0 0 0 62 67 1 1 0 0 0 67 68 1 0 0 0 0 63 69 1 6 0 0 0 65 70 1 6 0 0 0 71 68 1 1 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 76 1 0 0 0 0 76 71 1 0 0 0 0 76 77 1 6 0 0 0 75 78 1 1 0 0 0 74 79 1 6 0 0 0 M END > CFN99966 > Ginsenoside Rb3 > 68406-26-8 > 98% > C53H90O22 > 1079.27 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rb3-CFN99966.html $$$$ -ISIS- 10201511232D 60 65 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -1.6167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -1.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -1.1667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -1.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7167 -10.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4958 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7167 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0583 -8.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 20 36 1 1 0 0 0 15 37 1 6 0 0 0 38 36 1 1 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 38 1 0 0 0 0 42 44 1 1 0 0 0 40 45 1 1 0 0 0 45 46 1 0 0 0 0 41 47 1 6 0 0 0 43 48 1 6 0 0 0 7 49 1 6 0 0 0 50 49 1 6 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 50 1 0 0 0 0 54 56 1 6 0 0 0 52 57 1 6 0 0 0 51 58 1 1 0 0 0 53 59 1 1 0 0 0 56 60 1 0 0 0 0 M END > CFN99967 > Ginsenoside Rg1 > 22427-39-0 > 98% > C42H72O14 > 801.01 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rg1-CFN99967.html $$$$ -ISIS- 10201511232D 59 64 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7167 -10.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4958 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7167 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0583 -8.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -11.0833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3750 -11.5333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3750 -12.4375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -12.8875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9375 -12.4375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9375 -11.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -13.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -12.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -12.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 20 36 1 1 0 0 0 15 37 1 6 0 0 0 7 38 1 6 0 0 0 39 38 1 6 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 39 1 0 0 0 0 43 45 1 6 0 0 0 41 46 1 6 0 0 0 40 47 1 1 0 0 0 42 48 1 1 0 0 0 45 49 1 0 0 0 0 50 47 1 6 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 50 1 0 0 0 0 51 56 1 1 0 0 0 53 57 1 6 0 0 0 52 58 1 1 0 0 0 54 59 1 1 0 0 0 M END > CFN99968 > Ginsenoside Rg2 > 52286-74-5 > 98% > C42H72O13 > 785.02 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rg2-CFN99968.html $$$$ -ISIS- 10201511232D 59 64 0 0 0 0 0 0 0 0999 V2000 3.9000 -7.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6708 -9.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4417 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4417 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6708 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -8.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2167 -7.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7583 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7583 -6.5625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9875 -6.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2167 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -6.1167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3000 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -5.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -5.2250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7583 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -9.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2292 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0708 -5.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -8.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -5.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -6.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4250 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -8.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -5.2250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -8.7875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3583 -7.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8167 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8167 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -9.2333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -10.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -7.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -6.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -4.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -5.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -10.5667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0458 -10.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -10.5667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7250 -11.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0458 -11.9042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8167 -11.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4958 -10.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -12.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4958 -11.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -11.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -10.5667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 20 47 1 1 0 0 0 15 48 1 6 0 0 0 49 44 1 1 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 49 1 0 0 0 0 51 55 1 1 0 0 0 53 56 1 1 0 0 0 52 57 1 6 0 0 0 54 58 1 6 0 0 0 55 59 1 0 0 0 0 M END > CFN99969 > Ginsenoside Rg3 > 14197-60-5 > 98% > C42H72O13 > 785.02 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rg3-CFN99969.html $$$$ -ISIS- 10201511232D 49 53 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7167 -10.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4958 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7167 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0583 -8.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 20 36 1 1 0 0 0 15 37 1 6 0 0 0 7 38 1 6 0 0 0 39 38 1 6 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 39 1 0 0 0 0 43 45 1 6 0 0 0 41 46 1 6 0 0 0 40 47 1 1 0 0 0 42 48 1 1 0 0 0 45 49 1 0 0 0 0 M END > CFN99970 > Ginsenoside Rh1 > 63223-86-9 > 98% > C36H62O9 > 638.88 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rh1-CFN99970.html $$$$ -ISIS- 10201511232D 48 52 0 0 0 0 0 0 0 0999 V2000 3.9000 -7.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6708 -9.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4417 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4417 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6708 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -8.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2167 -7.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7583 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7583 -6.5625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9875 -6.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2167 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -6.1167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3000 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -5.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -5.2250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7583 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -9.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2292 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0708 -5.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -8.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -5.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -6.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4250 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -8.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -5.2250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -8.7875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3583 -7.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8167 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8167 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -9.2333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -10.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -7.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -6.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -4.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -5.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 20 47 1 1 0 0 0 15 48 1 6 0 0 0 M END > CFN99971 > 20(S)-Ginsenoside Rh2 > 78214-33-2 > 98% > C36H62O8 > 622.87 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rh2-CFN99971.html $$$$ -ISIS- 10201511232D 46 50 0 0 0 0 0 0 0 0999 V2000 3.9000 -7.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6708 -9.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4417 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4417 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6708 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -8.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2167 -7.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7583 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7583 -6.5625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9875 -6.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2167 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -6.1167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3000 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -7.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -5.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 -5.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -9.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2292 -10.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -4.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0708 -5.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7583 -8.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -5.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 -6.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4250 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -8.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -5.2250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -8.7875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3583 -7.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -7.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8167 -7.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8167 -8.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -9.2333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5875 -6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5875 -10.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -7.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8167 -6.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 0 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 2 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 15 20 1 1 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 M END > CFN99972 > Ginsenoside Rh3 > 105558-26-7 > 98% > C36H60O7 > 604.86 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rh3-CFN99972.html $$$$ -ISIS- 10201511232D 79 86 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 -7.0292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2458 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6833 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6833 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4667 -7.4792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4667 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -5.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -4.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8750 -9.7333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0958 -10.1833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6833 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6583 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6583 -10.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -10.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4375 -8.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -1.6167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -1.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -1.1667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6167 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4417 -0.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0458 0.4917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5917 1.2708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7125 1.0833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -1.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0417 1.6875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9167 0.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9583 2.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5542 0.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 36 34 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 42 1 1 0 0 0 40 43 1 1 0 0 0 41 44 1 6 0 0 0 39 45 1 6 0 0 0 42 46 1 0 0 0 0 20 47 1 1 0 0 0 15 48 1 6 0 0 0 49 44 1 1 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 49 1 0 0 0 0 51 55 1 1 0 0 0 53 56 1 1 0 0 0 52 57 1 6 0 0 0 54 58 1 6 0 0 0 55 59 1 0 0 0 0 60 47 1 1 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 65 60 1 0 0 0 0 64 66 1 1 0 0 0 62 67 1 1 0 0 0 67 68 1 0 0 0 0 69 68 1 1 0 0 0 69 70 1 0 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 69 1 0 0 0 0 63 74 1 6 0 0 0 65 75 1 6 0 0 0 73 76 1 6 0 0 0 71 77 1 6 0 0 0 72 78 1 1 0 0 0 77 79 1 0 0 0 0 M END > CFN99973 > Ginsenoside Rc > 11021-14-0 > 98% > C53H90O22 > 1079.27 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rc-CFN99973.html $$$$ -ISIS- 10201511232D 71 77 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -1.6167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -1.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -1.1667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -1.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7167 -10.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4958 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7167 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0583 -8.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -11.0833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3750 -11.5333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3750 -12.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -12.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9375 -12.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9375 -11.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -13.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -12.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -12.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -13.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 20 36 1 1 0 0 0 15 37 1 6 0 0 0 38 36 1 1 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 38 1 0 0 0 0 42 44 1 1 0 0 0 40 45 1 1 0 0 0 45 46 1 0 0 0 0 41 47 1 6 0 0 0 43 48 1 6 0 0 0 7 49 1 6 0 0 0 50 49 1 6 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 50 1 0 0 0 0 54 56 1 6 0 0 0 52 57 1 6 0 0 0 51 58 1 1 0 0 0 53 59 1 1 0 0 0 56 60 1 0 0 0 0 61 58 1 6 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 65 66 1 0 0 0 0 66 61 1 0 0 0 0 62 67 1 1 0 0 0 64 68 1 1 0 0 0 63 69 1 6 0 0 0 65 70 1 6 0 0 0 70 71 1 0 0 0 0 M END > CFN99975 > Ginsenoside Rd > 52705-93-8 > 98% > C48H82O19 > 963.17 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rd-CFN99975.html $$$$ -ISIS- 10201511232D 60 65 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -8.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7167 -10.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4958 -9.7333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 -8.8292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7167 -8.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -8.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0583 -8.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -11.0833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3750 -11.5333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3750 -12.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -12.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9375 -12.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9375 -11.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -11.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -13.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -12.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -12.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 -13.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 20 36 1 1 0 0 0 15 37 1 6 0 0 0 7 38 1 6 0 0 0 39 38 1 6 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 39 1 0 0 0 0 43 45 1 6 0 0 0 41 46 1 6 0 0 0 40 47 1 1 0 0 0 42 48 1 1 0 0 0 45 49 1 0 0 0 0 50 47 1 6 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 50 1 0 0 0 0 51 56 1 1 0 0 0 53 57 1 1 0 0 0 52 58 1 6 0 0 0 54 59 1 6 0 0 0 59 60 1 0 0 0 0 M END > CFN99976 > Ginsenoside Rf > 52286-58-5 > 98% > C42H72O14 > 801.01 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-Rf-CFN99976.html $$$$ -ISIS- 10201511232D 50 55 0 0 0 0 0 0 0 0999 V2000 3.1208 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1208 -5.7083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9125 -6.1667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7042 -5.7083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7042 -4.7917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9125 -4.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.1667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -4.7917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5042 -4.3333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0875 -4.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0875 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -2.9625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8833 -2.9625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6750 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6750 -4.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0875 -2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7042 -3.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3708 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7042 -6.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4583 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0875 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -3.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -5.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -6.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -2.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -7.5375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2958 -8.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0917 -8.9167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8833 -8.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8833 -7.5375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0917 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6750 -7.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0917 -9.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -8.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6750 -8.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4708 -7.5417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8833 -2.0500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8833 -3.8792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7667 -2.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2625 -1.5167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6875 -0.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8333 -1.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2375 -1.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1750 -1.4708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6708 -2.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5875 -0.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0875 -1.4708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 3 20 1 6 0 0 0 4 21 1 6 0 0 0 3 22 1 1 0 0 0 11 23 1 6 0 0 0 9 24 1 1 0 0 0 10 25 1 6 0 0 0 2 26 1 1 0 0 0 13 27 1 1 0 0 0 7 28 1 6 0 0 0 29 28 1 6 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 29 1 0 0 0 0 33 35 1 6 0 0 0 31 36 1 6 0 0 0 30 37 1 1 0 0 0 32 38 1 1 0 0 0 35 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 6 0 0 0 40 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 40 1 0 0 0 0 40 46 1 1 0 0 0 43 47 1 6 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 M END > CFN99977 > Pseudoginsenoside RT5 > 98474-78-3 > 98% > C36H62O10 > 654.88 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Pseudoginsenoside-RT5-CFN99977.html $$$$ -ISIS- 10201511232D 58 63 0 0 0 0 0 0 0 0999 V2000 3.8083 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8083 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3667 -7.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3667 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1542 -5.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -5.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -4.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9333 -4.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1542 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -4.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -4.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -5.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -3.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0375 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3667 -7.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -8.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8792 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -4.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4417 -3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -6.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -3.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 -1.6167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2750 -1.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4958 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7125 -0.2625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7125 -1.1667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9333 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0542 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8375 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4958 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 -1.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6167 0.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4000 -0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1792 0.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1792 1.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.4000 1.5375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6167 1.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8375 1.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4000 2.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9583 1.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -8.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 12 1 0 0 0 0 16 15 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 1 0 0 0 5 19 1 1 0 0 0 20 21 1 6 0 0 0 3 22 1 6 0 0 0 4 23 1 6 0 0 0 3 24 1 1 0 0 0 25 20 1 0 0 0 0 26 25 1 0 0 0 0 11 27 1 6 0 0 0 28 26 1 0 0 0 0 29 28 2 0 0 0 0 20 15 1 0 0 0 0 9 30 1 1 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 10 33 1 6 0 0 0 2 34 1 1 0 0 0 13 35 1 1 0 0 0 20 36 1 1 0 0 0 15 37 1 6 0 0 0 38 36 1 1 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 38 1 0 0 0 0 42 44 1 1 0 0 0 40 45 1 1 0 0 0 45 46 1 0 0 0 0 41 47 1 6 0 0 0 43 48 1 6 0 0 0 49 46 1 1 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 49 1 0 0 0 0 54 55 1 6 0 0 0 53 56 1 1 0 0 0 52 57 1 1 0 0 0 7 58 1 6 0 0 0 M END > CFN99978 > Ginsenoside F3 > 62025-50-7 > 98% > C41H70O13 > 770.99 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ginsenoside-F3-CFN99978.html $$$$ -ISIS- 10201511232D 37 40 0 0 0 0 0 0 0 0999 V2000 1.2000 -5.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -6.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9875 -7.0750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7750 -6.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7750 -5.7125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9875 -5.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5625 -7.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -6.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -5.7125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5625 -5.2583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1375 -5.2583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1375 -4.3500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3500 -3.8958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5625 -4.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 -7.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5333 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -4.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -4.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -6.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4417 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -7.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5625 -6.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -3.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -3.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7083 -4.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -5.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -2.9875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7083 -3.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2833 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0708 -2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8583 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0708 -3.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -2.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -2.9875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 3 16 1 1 0 0 0 5 17 1 1 0 0 0 9 18 1 1 0 0 0 11 19 1 6 0 0 0 3 20 1 6 0 0 0 4 21 1 6 0 0 0 10 22 1 6 0 0 0 12 23 1 1 0 0 0 24 12 1 0 0 0 0 25 24 1 0 0 0 0 25 26 1 0 0 0 0 11 26 1 0 0 0 0 24 28 1 6 0 0 0 27 29 1 0 0 0 0 30 27 1 0 0 0 0 31 30 1 0 0 0 0 32 31 1 0 0 0 0 33 32 2 0 0 0 0 34 33 1 0 0 0 0 33 35 1 0 0 0 0 27 36 1 6 0 0 0 27 24 1 0 0 0 0 2 15 1 1 0 0 0 13 37 1 1 0 0 0 M END > CFN99979 > (20R)-Protopanaxdiol > 7755-01-3 > 98% > C30H52O3 > 460.74 > White powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Protopanaxdiol-CFN99979.html $$$$ -ISIS- 10201511232D 38 41 0 0 0 0 0 0 0 0999 V2000 1.2000 -5.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -6.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9875 -7.0750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7750 -6.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7750 -5.7125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9875 -5.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5625 -7.0750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3500 -6.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -5.7125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5625 -5.2583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1375 -5.2583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1375 -4.3500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3500 -3.8958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5625 -4.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 -7.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5333 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -4.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -4.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -6.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4417 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -7.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5625 -6.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -3.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -3.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7083 -4.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -5.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -2.9875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7083 -3.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7083 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2833 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0708 -2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8583 -2.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0708 -3.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -2.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -2.9875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5625 -7.9833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 3 16 1 1 0 0 0 5 17 1 1 0 0 0 9 18 1 1 0 0 0 11 19 1 6 0 0 0 3 20 1 6 0 0 0 4 21 1 6 0 0 0 10 22 1 6 0 0 0 12 23 1 1 0 0 0 24 12 1 0 0 0 0 25 24 1 0 0 0 0 25 26 1 0 0 0 0 11 26 1 0 0 0 0 24 28 1 6 0 0 0 27 29 1 0 0 0 0 30 27 1 0 0 0 0 31 30 1 0 0 0 0 32 31 1 0 0 0 0 33 32 2 0 0 0 0 34 33 1 0 0 0 0 33 35 1 0 0 0 0 27 36 1 6 0 0 0 27 24 1 0 0 0 0 2 15 1 1 0 0 0 13 37 1 1 0 0 0 7 38 1 6 0 0 0 M END > CFN99980 > 20(R)-Protopanaxatriol > 1453-93-6 > 98% > C30H52O4 > 476.73 > White powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Protopanaxatriol-CFN99980.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 -0.1792 -6.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1792 -6.9625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5917 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3708 -6.9625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3708 -6.0625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5917 -5.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1417 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -6.0625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1417 -5.6208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6917 -5.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6917 -4.7250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9167 -4.2833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1417 -4.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9625 -7.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3708 -5.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -5.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6917 -3.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0417 -8.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3708 -7.8583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1458 -8.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 -4.2750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2458 -4.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -5.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6917 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 -3.3792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6917 -2.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1417 -6.5167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 -5.1708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -3.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0167 -3.3792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0167 -2.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -2.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 -2.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8833 -3.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4625 -4.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9208 -3.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 1 6 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 5 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 10 14 1 0 0 0 0 5 16 1 1 0 0 0 9 17 1 1 0 0 0 12 18 1 1 0 0 0 3 19 1 6 0 0 0 4 20 1 6 0 0 0 3 21 1 1 0 0 0 22 12 1 0 0 0 0 23 22 1 0 0 0 0 23 24 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 6 0 0 0 22 26 1 0 0 0 0 26 27 1 6 0 0 0 10 28 1 6 0 0 0 2 15 1 1 0 0 0 22 29 1 6 0 0 0 26 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 26 1 0 0 0 0 31 35 1 1 0 0 0 31 36 1 6 0 0 0 13 37 1 1 0 0 0 M END > CFN99981 > Panaxadiol > 19666-76-3 > 98% > C30H52O3 > 460.73 > White powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Panaxadiol-CFN99981.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 -0.1792 -6.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1792 -6.9625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5917 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3708 -6.9625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3708 -6.0625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5917 -5.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1417 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9167 -6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -6.0625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1417 -5.6208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6917 -5.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6917 -4.7250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9167 -4.2833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1417 -4.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9625 -7.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3708 -5.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9167 -5.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6917 -3.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0417 -8.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3708 -7.8583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1458 -8.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 -4.2750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2458 -4.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -5.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6917 -6.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 -3.3792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6917 -2.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1417 -6.5167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 -5.1708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -3.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0167 -3.3792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0167 -2.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -2.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 -2.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8833 -3.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4625 -4.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9208 -3.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1375 -8.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 1 6 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 5 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 10 14 1 0 0 0 0 5 16 1 1 0 0 0 9 17 1 1 0 0 0 12 18 1 1 0 0 0 3 19 1 6 0 0 0 4 20 1 6 0 0 0 3 21 1 1 0 0 0 22 12 1 0 0 0 0 23 22 1 0 0 0 0 23 24 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 6 0 0 0 22 26 1 0 0 0 0 26 27 1 1 0 0 0 10 28 1 6 0 0 0 2 15 1 1 0 0 0 22 29 1 6 0 0 0 26 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 26 1 0 0 0 0 31 35 1 1 0 0 0 31 36 1 6 0 0 0 13 37 1 1 0 0 0 7 38 1 6 0 0 0 M END > CFN99982 > Panaxatriol > 32791-84-7 > 98% > C30H52O4 > 476.73 > White powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Panaxatriol-CFN99982.html $$$$