-ISIS- 10201511232D 35 40 0 0 0 0 0 0 0 0999 V2000 1.2542 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2542 -8.7750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0542 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8542 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8542 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0542 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6500 -7.3917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2500 -7.3917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2500 -6.4708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4500 -6.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -6.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0417 -6.0125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8458 -6.4708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8458 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0417 -5.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6458 -6.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6458 -5.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8542 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -5.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4542 -9.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1042 -4.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5333 -4.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9958 -4.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -5.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8875 -4.2875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6875 -4.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0417 -6.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -6.9333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8458 -5.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2417 -4.6292 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 19 20 1 0 0 0 0 20 18 1 0 0 0 0 5 21 1 1 0 0 0 12 22 1 1 0 0 0 2 23 1 1 0 0 0 20 24 1 6 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 28 27 1 0 0 0 0 28 29 1 6 0 0 0 20 25 1 1 0 0 0 15 30 1 6 0 0 0 15 18 1 0 0 0 0 10 31 1 6 0 0 0 11 32 1 6 0 0 0 9 33 1 1 0 0 0 16 34 1 6 0 0 0 16 19 1 0 0 0 0 18 35 1 6 0 0 0 M END > CFN90706 > Pennogenin > 507-89-1 > 98% > C27H42O4 > 430.62 > Powder > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Pennogenin-CFN90706.html $$$$ -ISIS- 10201511232D 30 33 0 0 0 0 0 0 0 0999 V2000 1.9958 -4.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9958 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5708 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5708 -4.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 -3.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3583 -5.7083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -4.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -5.7083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7250 -5.2500 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.7250 -4.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -3.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -6.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -7.0708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5167 -6.6167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5167 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -7.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5167 -8.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3000 -7.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3000 -7.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5167 -9.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -6.1625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -7.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -8.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -7.9833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3583 -8.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -9.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3000 -6.1625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3042 -9.8083 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 7 4 1 0 0 0 0 8 7 1 0 0 0 0 8 9 2 0 0 0 0 5 9 1 0 0 0 0 8 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 9 1 0 0 0 0 10 14 1 0 0 0 0 14 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 15 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 21 16 1 0 0 0 0 19 22 1 0 0 0 0 10 23 1 6 0 0 0 15 24 1 6 0 0 0 18 25 1 0 0 0 0 26 25 1 0 0 0 0 27 26 1 0 0 0 0 25 28 2 0 0 0 0 16 29 1 1 0 0 0 22 30 1 0 0 0 0 M END > CFN90617 > Hirsutine > 7729-23-9 > 98% > C22H28N2O3 > 368.47 > Powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Hirsutine-CFN90617.html $$$$ -ISIS- 10201511232D 67 75 0 0 0 0 0 0 0 0999 V2000 7.3083 -6.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3083 -7.7792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0708 -8.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8375 -7.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8375 -6.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0708 -6.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6000 -8.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 -7.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 -6.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6000 -6.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1250 -6.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1250 -5.5750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3583 -5.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6000 -5.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9625 -6.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4792 -6.0167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.9625 -5.3042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.3208 -5.7417 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 13.3208 -4.8625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.4792 -4.5917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.2083 -3.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6000 -7.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5458 -8.2167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8375 -6.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1250 -4.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 -6.0167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9208 -6.7792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7333 -6.1542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1250 -7.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7833 -7.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7833 -6.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0208 -6.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2583 -6.8958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2583 -7.7750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0208 -8.2167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0208 -9.0958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -6.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0208 -5.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -8.2167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7833 -5.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7333 -7.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7333 -6.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9708 -6.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2083 -6.8958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2083 -7.7750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9708 -8.2167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9708 -5.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7833 -9.5375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7833 -10.4167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5458 -10.8583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3125 -10.4167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3125 -9.5375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5458 -9.0958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -10.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5458 -11.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0708 -9.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0708 -10.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9708 -9.0958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4458 -8.2167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4458 -6.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2083 -5.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0792 -6.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8417 -5.7417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.8417 -4.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0792 -4.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6042 -6.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2250 -3.9875 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 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 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 17 1 0 0 0 0 20 21 1 6 0 0 0 10 22 1 6 0 0 0 2 23 1 1 0 0 0 5 24 1 1 0 0 0 12 25 1 1 0 0 0 9 26 1 1 0 0 0 16 27 1 6 0 0 0 17 28 1 6 0 0 0 11 29 1 6 0 0 0 30 23 1 1 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 1 0 0 0 0 35 30 1 0 0 0 0 35 36 1 6 0 0 0 33 37 1 1 0 0 0 32 38 1 1 0 0 0 34 39 1 1 0 0 0 38 40 1 0 0 0 0 41 39 1 1 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 46 1 0 0 0 0 46 41 1 0 0 0 0 43 47 1 1 0 0 0 48 36 1 6 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 49 54 1 1 0 0 0 50 55 1 1 0 0 0 52 56 1 1 0 0 0 51 57 1 6 0 0 0 46 58 1 6 0 0 0 45 59 1 1 0 0 0 44 60 1 6 0 0 0 47 61 1 0 0 0 0 18 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 19 1 0 0 0 0 63 66 1 6 0 0 0 19 67 1 6 0 0 0 M END > CFN90560 > alpha-Solanine > 20562-02-1 > 98% > C45H73NO15 > 868.06 > Powder > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/alpha-Solanine-CFN90560.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 0.5750 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -8.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3708 -8.6917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1708 -8.2333 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1708 -7.3083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3708 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9708 -8.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7667 -8.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7667 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9708 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5667 -6.8500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5667 -5.9250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7667 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9708 -5.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4458 -7.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -6.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4458 -5.6417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2208 -8.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7292 -4.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1125 -4.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6292 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2417 -5.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1417 -5.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7542 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6542 -5.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2708 -6.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -4.6875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5667 -5.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1708 -6.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9125 -9.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8042 -7.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8333 -9.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4667 -6.6250 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 11 31 1 6 0 0 0 3 32 1 6 0 0 0 24 33 1 0 0 0 0 M END > CFN92727 > Anwuweizonic acid > 117020-59-4 > 98% > C30H46O3 > 454.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Anwuweizonic-acid-CFN92727.html $$$$ -ISIS- 10201511232D 21 22 0 0 0 0 0 0 0 0999 V2000 4.1833 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1833 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -5.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -5.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -7.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -5.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -7.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8625 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6458 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6458 -5.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8625 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6208 -5.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 9 5 1 0 0 0 0 7 10 2 0 0 0 0 1 11 1 0 0 0 0 3 12 1 0 0 0 0 9 13 1 0 0 0 0 8 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 11 21 1 0 0 0 0 M END > CFN92661 > Flavokawain B > 1775-97-9 > 98% > C17H16O4 > 284.3 > Yellow powder > Chalcones > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Flavokawain-B-CFN92661.html $$$$ -ISIS- 10201511232D 21 22 0 0 0 0 0 0 0 0999 V2000 2.6792 -6.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6792 -7.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4833 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2875 -7.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2875 -6.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4833 -6.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -6.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 -6.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5125 -6.6667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3250 -6.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3250 -5.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5125 -4.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1208 -6.6667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5125 -3.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -3.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -8.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0625 -7.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8708 -6.2000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0625 -6.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 9 2 0 0 0 0 11 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 2 18 1 0 0 0 0 18 19 1 0 0 0 0 1 20 1 0 0 0 0 20 21 1 0 0 0 0 M END > CFN92660 > Hispidin > 56070-89-4 > 98% > C16H16O5 > 288.3 > Cryst. > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Hispidin-CFN92660.html $$$$ -ISIS- 10201511232D 56 60 0 0 0 0 0 0 0 0999 V2000 5.4917 -6.6792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9583 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4958 -8.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.8917 -7.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9583 -9.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5625 -8.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4958 -9.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8917 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9583 -10.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5625 -9.9083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0958 -10.7125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1667 -10.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5625 -11.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -11.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -9.9083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7708 -9.9083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9583 -5.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5625 -6.6792 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.0958 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0958 -5.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5625 -5.0667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1667 -5.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7000 -6.6792 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7667 -6.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3042 -7.4875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3042 -5.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7667 -8.2917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 1.3042 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3708 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -5.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3708 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3042 -10.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -6.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8917 -5.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3583 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2917 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7583 -5.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2917 -5.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3583 -5.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6875 -5.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7917 -8.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4542 -9.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3542 -9.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -8.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9333 -7.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0333 -7.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4958 -8.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3708 -5.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -5.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -5.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4917 -5.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -6.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4917 -4.2583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -3.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -8.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1542 -8.7958 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 2 4 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 1 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 6 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 1 17 1 1 0 0 0 1 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 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 24 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 16 1 0 0 0 0 28 29 2 0 0 0 0 22 30 1 1 0 0 0 25 31 1 1 0 0 0 16 32 1 1 0 0 0 31 33 1 0 0 0 0 17 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 38 1 0 0 0 0 38 39 2 0 0 0 0 39 34 1 0 0 0 0 37 40 1 0 0 0 0 8 41 1 0 0 0 0 41 42 2 0 0 0 0 42 43 1 0 0 0 0 43 44 2 0 0 0 0 44 45 1 0 0 0 0 45 46 2 0 0 0 0 46 41 1 0 0 0 0 45 40 1 0 0 0 0 44 47 1 0 0 0 0 33 48 2 0 0 0 0 48 49 1 0 0 0 0 49 50 2 0 0 0 0 50 51 1 0 0 0 0 51 52 2 0 0 0 0 52 33 1 0 0 0 0 50 53 1 0 0 0 0 53 54 1 0 0 0 0 27 55 1 0 0 0 0 47 56 1 0 0 0 0 M END > CFN92604 > RA VII > 86229-97-2 > 98% > C41H50N6O9 > 770.9 > Powder > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/RA-VII-CFN92604.html $$$$ -ISIS- 10201511232D 52 58 0 0 0 0 0 0 0 0999 V2000 6.3542 -7.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3542 -8.3417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1250 -8.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -8.3417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8917 -7.4542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1250 -7.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -8.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -8.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -7.4542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6625 -7.0083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1958 -7.0083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1958 -6.1208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4333 -5.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -6.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9667 -5.6792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7375 -6.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7375 -7.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1958 -5.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9667 -4.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1958 -4.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7375 -4.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1958 -3.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7375 -3.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -3.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1958 -7.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5833 -8.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -7.8958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8917 -9.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -6.5667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7375 -5.2333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8167 -8.3417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8167 -7.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0458 -7.0083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2750 -7.4542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2750 -8.3417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0458 -8.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0458 -6.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5083 -7.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5083 -8.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7375 -8.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5083 -6.1208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2792 -5.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2792 -4.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5083 -4.3458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7375 -4.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7375 -5.6792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9708 -4.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0458 -4.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9708 -6.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5083 -3.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0458 -3.4583 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 5 18 1 1 0 0 0 12 19 1 1 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 11 26 1 1 0 0 0 2 27 1 1 0 0 0 10 28 1 6 0 0 0 4 29 1 1 0 0 0 9 30 1 1 0 0 0 15 20 1 0 0 0 0 15 31 1 6 0 0 0 32 27 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 1 0 0 0 35 39 1 6 0 0 0 36 40 1 6 0 0 0 40 41 1 0 0 0 0 42 39 1 1 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 46 48 1 1 0 0 0 44 49 1 1 0 0 0 47 50 1 6 0 0 0 45 51 1 6 0 0 0 49 52 1 0 0 0 0 M END > CFN90513 > Periplocin > 13137-64-9 > 98% > C36H56O13 > 696.82 > Powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Periplocin-CFN90513.html $$$$ -ISIS- 10201511232D 24 28 0 0 0 0 0 0 0 0999 V2000 -3.4417 -2.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4417 -3.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9208 -3.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4042 -3.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4042 -2.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9208 -2.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8833 -3.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -3.3292 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3625 -2.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8833 -2.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8833 -4.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -4.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8417 -4.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8417 -3.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 -5.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8417 -5.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -5.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -4.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1958 -4.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1958 -5.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7125 -5.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0125 -2.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3667 -3.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0125 -3.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 8 1 0 0 0 0 12 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 13 1 0 0 0 0 18 19 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 1 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 2 1 0 0 0 0 M CHG 1 8 1 M END > CFN90509 > Berberrubine > 15401-69-1 > 98% > C19H16NO4+ > 322.33 > Powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Berberrubine-CFN90509.html $$$$ -ISIS- 10201511232D 19 21 0 0 0 0 0 0 0 0999 V2000 3.2167 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2167 -7.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 -7.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -7.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2542 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0667 -7.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0667 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2542 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -4.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -8.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8708 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6792 -6.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2542 -4.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 8 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 9 1 0 0 0 0 10 15 2 0 0 0 0 7 16 2 0 0 0 0 13 17 1 0 0 0 0 17 18 1 0 0 0 0 14 19 1 0 0 0 0 M END > CFN92536 > Digiferruginol > 24094-45-9 > 98% > C15H10O4 > 254.2 > Yellow cryst. > Anthraquinones > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Digiferruginol-CFN92536.html $$$$ -ISIS- 10201511232D 21 23 0 0 0 0 0 0 0 0999 V2000 4.0083 -5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0083 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 -6.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6583 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6583 -5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 -4.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4792 -6.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4792 -4.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1208 -6.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4792 -7.7333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1208 -7.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9458 -8.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7750 -7.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7750 -6.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9458 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1875 -4.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9458 -9.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5958 -6.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4208 -6.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 8 11 1 0 0 0 0 7 12 2 0 0 0 0 11 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 11 1 0 0 0 0 1 18 1 0 0 0 0 14 19 1 0 0 0 0 16 20 1 0 0 0 0 20 21 1 0 0 0 0 M END > CFN92389 > 7,3'-Dihydroxy-5'-methoxyisoflavone > 947611-61-2 > 98% > C16H12O5 > 284.3 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/7-3-Dihydroxy-5-methoxyisoflavone-CFN92389.html $$$$ -ISIS- 10201511232D 43 46 0 0 0 0 0 0 0 0999 V2000 -2.6125 -4.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6125 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8125 -6.2375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0125 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0125 -4.8500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8125 -4.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2083 -6.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5917 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5917 -4.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2083 -4.3875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3958 -4.3875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3958 -3.4625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5917 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2083 -3.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -4.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8208 -3.9250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2750 -3.1750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4167 -4.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4167 -6.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -7.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -7.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0083 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0125 -3.9250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4917 -5.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4917 -2.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5917 -3.9250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2083 -5.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5625 -2.2958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4667 -2.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9417 -1.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1208 -2.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7292 -1.2167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0125 -2.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6667 -3.1708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5625 -2.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4292 -4.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3250 -3.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -3.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 -1.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1708 -2.9333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2167 -3.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8708 -4.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -2.6958 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 1 18 1 1 0 0 0 2 19 2 0 0 0 0 3 20 1 1 0 0 0 3 21 1 6 0 0 0 14 22 2 0 0 0 0 5 23 1 6 0 0 0 11 24 1 6 0 0 0 12 25 1 1 0 0 0 9 26 1 1 0 0 0 10 27 1 1 0 0 0 17 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 6 0 0 0 29 31 1 0 0 0 0 29 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 16 38 1 6 0 0 0 28 39 1 1 0 0 0 17 40 1 6 0 0 0 37 41 1 0 0 0 0 41 42 1 0 0 0 0 41 43 2 0 0 0 0 M END > CFN92140 > Dihydrocucurbitacin B > 13201-14-4 > 98% > C32H48O8 > 560.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Dihydrocucurbitacin-B-CFN92140.html $$$$ -ISIS- 10201511232D 31 35 0 0 0 0 0 0 0 0999 V2000 4.3958 -2.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -3.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -3.7250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9625 -3.2750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9625 -2.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1833 -1.9167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1833 -4.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -5.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -5.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 -5.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 -5.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -7.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7542 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7542 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6208 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6208 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6125 -1.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -2.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -3.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6125 -3.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -2.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4417 -2.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -3.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8292 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3625 -2.8208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8292 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1083 -4.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 -1.4667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 -4.1792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -1.0125 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 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 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 2 0 0 0 0 12 7 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 9 16 1 0 0 0 0 16 17 1 0 0 0 0 1 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 2 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 20 1 0 0 0 0 25 4 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 5 27 1 0 0 0 0 25 28 2 0 0 0 0 5 29 1 6 0 0 0 4 30 1 1 0 0 0 6 31 1 6 0 0 0 M END > CFN90483 > 4'-Demethylpodophyllotoxin > 40505-27-9 > 98% > C21H20O8 > 400.37 > Cryst. > Lignans > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-Demethylpodophyllotoxin-CFN90483.html $$$$ -ISIS- 10201511232D 69 76 0 0 0 0 0 0 0 0999 V2000 4.5333 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5333 -8.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2667 -8.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -8.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2667 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7333 -8.6292 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.4667 -8.2042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4667 -7.3583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2000 -8.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9375 -8.2042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9375 -7.3583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2000 -6.9333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8000 -8.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6708 -6.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6708 -6.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9375 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2000 -6.0875 0.0000 N 0 0 2 0 0 0 0 0 0 0 0 0 9.6708 -7.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2000 -7.7792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3833 -5.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -6.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7792 -9.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 -9.3625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -9.7833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -9.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9542 -10.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6667 -8.6250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 -9.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1333 -8.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 -9.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1333 -9.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3167 -9.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3542 -10.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7333 -7.7792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -5.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1125 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8458 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8458 -5.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1125 -4.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5792 -6.4083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 -5.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0458 -6.4083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7792 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7792 -5.1375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0458 -4.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -4.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -3.8667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7792 -3.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0458 -3.8667 0.0000 N 0 0 2 0 0 0 0 0 0 0 0 0 4.5125 -5.5625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2292 -3.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7125 -4.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6208 -7.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8875 -7.5667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2208 -7.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7958 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -9.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3333 -3.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -3.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9292 -4.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0333 -3.0333 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 9.0333 -2.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0333 -3.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1833 -3.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8792 -3.0333 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 7 4 1 0 0 0 0 8 7 1 0 0 0 0 8 9 1 0 0 0 0 5 9 1 0 0 0 0 8 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 9 1 0 0 0 0 2 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 13 1 0 0 0 0 12 19 1 6 0 0 0 13 20 1 6 0 0 0 18 21 1 1 0 0 0 9 22 1 1 0 0 0 21 22 1 1 0 0 0 19 23 1 0 0 0 0 10 24 1 6 0 0 0 10 25 1 1 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 11 29 1 1 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 7 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 8 36 1 1 0 0 0 37 38 2 0 0 0 0 38 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 37 1 0 0 0 0 43 40 1 0 0 0 0 44 43 1 0 0 0 0 44 45 2 0 0 0 0 41 45 1 0 0 0 0 44 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 48 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 49 1 0 0 0 0 48 54 1 6 0 0 0 53 55 1 1 0 0 0 45 56 1 1 0 0 0 55 56 1 1 0 0 0 46 57 1 1 0 0 0 57 58 2 0 0 0 0 57 59 1 0 0 0 0 59 60 1 0 0 0 0 14 61 1 0 0 0 0 46 1 1 6 0 0 0 51 62 1 0 0 0 0 51 63 1 1 0 0 0 62 64 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 65 66 2 0 0 0 0 65 67 2 0 0 0 0 65 68 1 0 0 0 0 65 69 1 0 0 0 0 M END > CFN90400 > Vincristine sulfate > 2068-78-2 > 98% > C46H58N4O14S > 923.04 > Powder > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Vincristine-sulfate-CFN90400.html $$$$ -ISIS- 10201511232D 29 34 0 0 0 0 0 0 0 0999 V2000 -0.0667 -6.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0667 -7.4542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7208 -7.9083 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5042 -7.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5042 -6.5458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7208 -6.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2917 -7.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0792 -7.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0792 -6.5458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2917 -6.0917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1583 -6.9708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0292 -5.5583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7458 -4.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8375 -4.6917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5583 -5.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9292 -4.6917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8375 -3.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2917 -2.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3833 -2.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1042 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -5.7583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -5.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7208 -8.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5042 -9.2708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0667 -9.2708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8542 -8.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8708 -7.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 -6.3083 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 10 5 1 0 0 0 0 4 11 1 6 0 0 0 10 12 1 6 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 10 15 1 1 0 0 0 14 16 1 6 0 0 0 14 17 1 1 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 17 1 0 0 0 0 5 22 1 1 0 0 0 11 23 1 0 0 0 0 12 23 1 6 0 0 0 3 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 2 28 1 6 0 0 0 28 11 1 6 0 0 0 9 29 1 6 0 0 0 10 9 1 0 0 0 0 M END > CFN90374 > Crovatin > 142409-09-4 > 98% > C21H26O6 > 374.43 > Cryst. > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Crovatin-CFN90374.html $$$$ -ISIS- 10201511232D 63 69 0 0 0 0 0 0 0 0999 V2000 8.0333 -7.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1833 -7.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7583 -8.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1833 -9.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0333 -9.0625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4583 -8.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7708 -7.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5917 -7.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0167 -8.1208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0167 -8.9708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2833 -9.3958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7542 -9.3958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4917 -8.9708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4917 -8.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7542 -7.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7583 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9083 -8.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5042 -10.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2333 -7.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0167 -9.8167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -6.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7542 -6.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0333 -9.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1958 -8.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1958 -7.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0167 -6.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1792 -10.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9167 -9.7083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5375 -10.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9625 -10.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5375 -11.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8083 -10.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9792 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -4.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8292 -5.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0792 -10.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2292 -10.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8042 -10.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9542 -10.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5292 -10.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9542 -11.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8042 -11.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5042 -11.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -7.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -8.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7042 -7.9000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9667 -8.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -7.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -9.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2333 -7.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4958 -8.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4958 -9.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2333 -9.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 -9.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -7.0500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 -6.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 -5.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2333 -7.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -4.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 -4.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2333 -4.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2333 -5.3542 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 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 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 5 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 15 1 0 0 0 0 15 9 1 0 0 0 0 2 16 1 0 0 0 0 3 17 1 6 0 0 0 11 18 1 6 0 0 0 9 19 1 1 0 0 0 10 20 1 6 0 0 0 7 21 1 1 0 0 0 15 22 1 6 0 0 0 5 23 1 1 0 0 0 6 24 1 6 0 0 0 6 25 1 1 0 0 0 8 26 2 0 0 0 0 27 28 1 0 0 0 0 13 28 1 1 0 0 0 12 27 1 1 0 0 0 12 29 1 6 0 0 0 30 29 1 0 0 0 0 31 30 1 0 0 0 0 30 32 2 0 0 0 0 21 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 18 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 38 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 37 1 0 0 0 0 36 43 2 0 0 0 0 17 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 44 48 2 0 0 0 0 45 49 1 6 0 0 0 47 50 2 0 0 0 0 50 51 1 0 0 0 0 51 52 2 0 0 0 0 52 53 1 0 0 0 0 53 54 2 0 0 0 0 54 47 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 56 58 2 0 0 0 0 46 55 1 6 0 0 0 57 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 57 1 0 0 0 0 M END > CFN90371 > 7-Epitaxol > 105454-04-4 > 98% > C47H51NO14 > 853.91 > Cryst. > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/7-Epitaxol-CFN90371.html $$$$ -ISIS- 10201511232D 26 28 0 0 0 0 0 0 0 0999 V2000 4.6292 -7.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6292 -8.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7667 -6.9375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2417 -7.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7667 -8.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -8.6917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2208 -8.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6167 -7.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2208 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -6.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4917 -9.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 -7.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2667 -9.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0917 -9.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -9.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -10.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9792 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8750 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 -6.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3375 -7.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3375 -6.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1125 -5.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5667 -4.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5917 -6.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5917 -9.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8833 -5.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 2 2 0 0 0 0 2 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 1 2 0 0 0 0 5 11 1 0 0 0 0 8 12 1 6 0 0 0 6 13 1 6 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 12 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 7 15 1 1 0 0 0 10 22 1 0 0 0 0 22 23 2 0 0 0 0 24 22 1 0 0 0 0 15 25 2 0 0 0 0 3 24 1 6 0 0 0 21 26 1 0 0 0 0 M END > CFN97798 > Scabertopin > 185213-52-9 > 98% > C20H22O6 > 358.39 > Powder > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Scabertopin-CFN97798.html $$$$ -ISIS- 10201511232D 28 32 0 0 0 0 0 0 0 0999 V2000 -1.9583 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9583 -8.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1708 -8.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3833 -8.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3833 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1708 -7.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4042 -8.9708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1917 -8.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1917 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4042 -7.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0583 -8.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5917 -8.0625 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.0583 -7.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 -9.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3333 -9.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8708 -8.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -8.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -10.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6083 -10.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -9.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0333 -7.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9792 -11.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 -11.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -10.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0375 -10.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4042 -6.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3833 -5.7917 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 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 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 9 1 0 0 0 0 11 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 12 1 0 0 0 0 15 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 16 1 0 0 0 0 17 22 2 0 0 0 0 19 23 2 0 0 0 0 18 24 1 1 0 0 0 18 25 1 6 0 0 0 25 26 1 0 0 0 0 10 27 1 0 0 0 0 27 28 1 0 0 0 0 M END > CFN90336 > 7-Ethylcamptothecin > 78287-27-1 > 98% > C22H20N2O4 > 376.41 > Cryst. > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/7-Ethylcamptothecin-CFN90336.html $$$$ -ISIS- 10201511232D 63 69 0 0 0 0 0 0 0 0999 V2000 8.0333 -7.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1833 -7.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7583 -8.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1833 -9.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0333 -9.0625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4583 -8.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7708 -7.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5917 -7.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0167 -8.1208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0167 -8.9708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2833 -9.3958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7542 -9.3958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4917 -8.9708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4917 -8.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7542 -7.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7583 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9083 -8.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5042 -10.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2333 -7.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0167 -9.8167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -6.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7542 -6.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0333 -9.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1958 -8.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1958 -7.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0167 -6.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1792 -10.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9167 -9.7083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5375 -10.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9625 -10.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5375 -11.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8083 -10.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9792 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -4.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8292 -5.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0792 -10.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2292 -10.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8042 -10.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9542 -10.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5292 -10.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9542 -11.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8042 -11.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5042 -11.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -7.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -8.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7042 -7.9000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9667 -8.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -7.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -9.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2333 -7.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4958 -8.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4958 -9.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2333 -9.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 -9.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -7.0500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 -6.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 -5.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2333 -7.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -5.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -4.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 -4.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2333 -4.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2333 -5.3542 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 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 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 5 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 15 1 0 0 0 0 15 9 1 0 0 0 0 2 16 1 0 0 0 0 3 17 1 6 0 0 0 11 18 1 6 0 0 0 9 19 1 1 0 0 0 10 20 1 6 0 0 0 7 21 1 1 0 0 0 15 22 1 1 0 0 0 5 23 1 1 0 0 0 6 24 1 6 0 0 0 6 25 1 1 0 0 0 8 26 2 0 0 0 0 27 28 1 0 0 0 0 13 28 1 1 0 0 0 12 27 1 1 0 0 0 12 29 1 6 0 0 0 30 29 1 0 0 0 0 31 30 1 0 0 0 0 30 32 2 0 0 0 0 21 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 18 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 38 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 37 1 0 0 0 0 36 43 2 0 0 0 0 17 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 44 48 2 0 0 0 0 45 49 1 6 0 0 0 47 50 2 0 0 0 0 50 51 1 0 0 0 0 51 52 2 0 0 0 0 52 53 1 0 0 0 0 53 54 2 0 0 0 0 54 47 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 56 58 2 0 0 0 0 46 55 1 6 0 0 0 57 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 57 1 0 0 0 0 M END > CFN97759 > Paclitaxel > 33069-62-4 > 98% > C47H51NO14 > 853.92 > Powder > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Paclitaxel-CFN97759.html $$$$ -ISIS- 10201511232D 23 25 0 0 0 0 0 0 0 0999 V2000 1.4542 -2.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4542 -3.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -3.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0875 -3.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0875 -2.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -2.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -3.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -3.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -2.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -2.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6417 -2.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -4.8625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -4.8625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5375 -2.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 -2.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 -3.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -3.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9875 -3.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9875 -2.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -2.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8000 -3.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6417 -3.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -3.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 1 11 1 0 0 0 0 3 12 1 0 0 0 0 7 13 2 0 0 0 0 9 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 18 21 1 0 0 0 0 2 22 1 0 0 0 0 22 23 1 0 0 0 0 M END > CFN90317 > Capillarisin > 56365-38-9 > 98% > C16H12O7 > 316.26 > Powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Capillarisin-CFN90317.html $$$$ -ISIS- 10201511232D 27 31 0 0 0 0 0 0 0 0999 V2000 -1.9583 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9583 -8.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1708 -8.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3833 -8.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3833 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1708 -7.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4042 -8.9708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1917 -8.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1917 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4042 -7.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0583 -8.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5917 -8.0625 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.0583 -7.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 -9.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3333 -9.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8708 -8.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -8.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -10.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6083 -10.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -9.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -9.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0333 -7.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9792 -11.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 -11.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -10.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0375 -10.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1708 -6.2458 0.0000 N 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 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 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 9 1 0 0 0 0 11 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 12 1 0 0 0 0 15 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 16 1 0 0 0 0 17 22 2 0 0 0 0 19 23 2 0 0 0 0 18 24 1 1 0 0 0 18 25 1 6 0 0 0 25 26 1 0 0 0 0 6 27 1 0 0 0 0 M END > CFN90309 > 9-Aminocamptothecin > 91421-43-1 > 98% > C20H17N3O4 > 363.37 > Cryst. > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/9-Aminocamptothecin-CFN90309.html $$$$ -ISIS- 10201511232D 25 27 0 0 0 0 0 0 0 0999 V2000 4.6292 -7.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6292 -8.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7667 -6.9375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2417 -7.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7667 -8.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -8.6917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2208 -8.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6167 -7.6708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2208 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3458 -6.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4917 -9.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 -7.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2667 -9.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0917 -9.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -9.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -10.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9792 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8750 -6.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 -6.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3375 -7.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3375 -6.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1125 -5.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5667 -4.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5917 -6.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5917 -9.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 2 2 0 0 0 0 2 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 1 2 0 0 0 0 5 11 1 0 0 0 0 8 12 1 6 0 0 0 6 13 1 6 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 12 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 7 15 1 1 0 0 0 10 22 1 0 0 0 0 22 23 2 0 0 0 0 24 22 1 0 0 0 0 15 25 2 0 0 0 0 3 24 1 6 0 0 0 M END > CFN97745 > Isodeoxyelephantopin > 38927-54-7 > 98% > C19H20O6 > 344.36 > Powder > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Isodeoxyelephantopin-CFN97745.html $$$$ -ISIS- 10201511232D 25 27 0 0 0 0 0 0 0 0999 V2000 9.5458 -6.4458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.9875 -5.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8708 -5.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3125 -6.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1958 -6.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6375 -5.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1958 -4.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3125 -4.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -6.4458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3875 -7.2875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1042 -7.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8167 -7.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5167 -5.6875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2250 -5.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3417 -5.6875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6375 -7.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5125 -7.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5042 -7.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0667 -6.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1833 -6.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -7.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1833 -8.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0667 -8.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -5.7583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8583 -7.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 2 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 3 1 0 0 0 0 1 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 1 1 0 0 0 0 6 13 1 0 0 0 0 14 15 1 0 0 0 0 5 16 1 0 0 0 0 16 17 1 0 0 0 0 9 14 1 1 0 0 0 1 2 1 1 0 0 0 10 18 1 6 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 18 1 0 0 0 0 20 24 1 0 0 0 0 21 25 1 0 0 0 0 M END > CFN97744 > Taxiresinol > 40951-69-7 > 98% > C19H22O6 > 346.38 > Powder > Lignans > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Taxiresinol-CFN97744.html $$$$ -ISIS- 10201511232D 10 10 0 0 0 0 0 0 0 0999 V2000 1.4250 -8.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -9.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2625 -9.8458 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1000 -9.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -8.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2625 -7.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9375 -7.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7708 -8.3958 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9375 -6.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2625 -10.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 3 10 1 0 0 0 0 M CHG 2 3 1 8 -1 M END > CFN90225 > Trigonelline > 535-83-1 > 98% > C7H7NO2 > 137.14 > Powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Trigonelline-CFN90225.html $$$$ -ISIS- 10201511232D 31 35 0 0 0 0 0 0 0 0999 V2000 4.0583 -7.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0583 -8.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8583 -8.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6542 -8.3542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6542 -7.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8583 -6.9708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4500 -8.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2458 -8.3542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2458 -7.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4500 -6.9708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0458 -6.9708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0458 -6.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2458 -5.5917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4500 -6.0500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0458 -8.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8375 -8.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8375 -7.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8583 -6.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6542 -6.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0458 -7.8917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2458 -9.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2458 -4.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7083 -6.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3708 -6.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6542 -5.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6542 -9.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8375 -5.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2583 -6.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8583 -9.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6375 -8.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -7.8917 0.0000 H 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 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 8 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 6 18 1 1 0 0 0 5 19 1 1 0 0 0 11 20 1 1 0 0 0 8 21 1 1 0 0 0 9 23 1 1 0 0 0 14 24 1 1 0 0 0 24 23 1 0 0 0 0 14 25 1 6 0 0 0 4 26 1 6 0 0 0 12 27 2 0 0 0 0 1 28 2 0 0 0 0 3 29 1 0 0 0 0 16 30 2 0 0 0 0 10 31 1 6 0 0 0 13 22 1 6 0 0 0 M END > CFN97561 > Ailanthone > 981-15-7 > 98% > C20H24O7 > 376.4 > Powder > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ailanthone-CFN97561.html $$$$ -ISIS- 10201511232D 26 29 0 0 0 0 0 0 0 0999 V2000 3.4333 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 -7.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2125 -7.6958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9917 -7.2458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9917 -6.3458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2125 -5.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -7.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -7.2458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5500 -6.3458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7708 -5.8958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3292 -5.8958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3292 -4.9958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5500 -4.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -4.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -6.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1125 -5.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1083 -6.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1125 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8917 -5.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -5.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 -8.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7625 -8.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -8.1458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -7.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -6.7958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -7.6958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 9 15 1 1 0 0 0 12 16 1 1 0 0 0 16 15 1 0 0 0 0 15 18 2 0 0 0 0 16 19 2 0 0 0 0 5 20 1 6 0 0 0 3 21 1 6 0 0 0 3 22 1 1 0 0 0 4 23 1 1 0 0 0 8 24 1 6 0 0 0 11 17 1 1 0 0 0 10 25 1 1 0 0 0 2 26 2 0 0 0 0 M END > CFN90207 > Glaucocalyxin A > 79498-31-0 > 98% > C20H28O4 > 332.43 > White powder > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Glaucocalyxin-A-CFN90207.html $$$$ -ISIS- 10201511232D 27 28 0 0 0 0 0 0 0 0999 V2000 2.9208 -5.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9208 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -7.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -5.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -5.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -7.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0417 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0417 -5.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -5.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -8.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -4.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8208 -5.3333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6000 -5.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3833 -5.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1667 -5.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1667 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9458 -5.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -4.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -8.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8208 -4.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 -3.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 -4.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 -3.0792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1583 -3.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1542 -3.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -4.4250 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 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 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 7 11 2 0 0 0 0 10 12 2 0 0 0 0 13 9 1 0 0 0 0 14 13 1 0 0 0 0 15 14 1 0 0 0 0 16 15 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 6 19 1 0 0 0 0 3 20 1 0 0 0 0 13 21 1 6 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 25 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M END > CFN90164 > Dimethylacrylshikonin > 24502-79-2 > 98% > C21H22O6 > 370.39 > Powder > Quinones > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Dimethylacrylshikonin-CFN90164.html $$$$ -ISIS- 10201511232D 12 13 0 0 0 0 0 0 0 0999 V2000 4.6750 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -7.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3375 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3375 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9958 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -5.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8250 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8458 -7.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 M END > CFN97503 > Umbelliferone > 93-35-6 > 98% > C9H6O3 > 162.1 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Umbelliferone-CFN97503.html $$$$ -ISIS- 10201511232D 67 74 0 0 0 0 0 0 0 0999 V2000 4.1792 -3.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1792 -4.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9125 -4.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6458 -4.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6458 -3.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9125 -3.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3792 -4.8458 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.1125 -4.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1125 -3.5750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8458 -4.8458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5833 -4.4208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -3.5750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8458 -3.1500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4458 -4.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3167 -3.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3167 -2.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -1.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8458 -2.3042 0.0000 N 0 0 2 0 0 0 0 0 0 0 0 0 9.3167 -3.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8458 -3.9958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0292 -2.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5167 -2.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0458 -3.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2708 -5.5792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6917 -6.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 -6.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 -6.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3125 -4.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0458 -5.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7792 -4.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0458 -6.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3792 -3.9958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9792 -1.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9792 -2.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2417 -2.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4917 -2.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4917 -1.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2417 -0.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -2.6250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9583 -2.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9583 -1.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6917 -2.6250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4250 -2.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -1.3542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6917 -0.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1583 -0.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1583 -0.0833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4250 0.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6917 -0.0833 0.0000 N 0 0 2 0 0 0 0 0 0 0 0 0 4.1583 -1.7792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 0.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3583 -0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2667 -3.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5333 -3.7833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8667 -3.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4417 -4.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4458 -5.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9792 0.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3792 0.7333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -0.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9583 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1292 -7.3958 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 2.1292 -6.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1292 -8.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -7.3958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2833 -7.3958 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 7 4 1 0 0 0 0 8 7 1 0 0 0 0 8 9 1 0 0 0 0 5 9 1 0 0 0 0 8 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 9 1 0 0 0 0 2 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 13 1 0 0 0 0 12 19 1 6 0 0 0 13 20 1 6 0 0 0 18 21 1 1 0 0 0 9 22 1 1 0 0 0 21 22 1 1 0 0 0 19 23 1 0 0 0 0 10 24 1 6 0 0 0 10 25 1 1 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 11 29 1 1 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 8 33 1 1 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 38 1 0 0 0 0 38 39 2 0 0 0 0 39 34 1 0 0 0 0 40 37 1 0 0 0 0 41 40 1 0 0 0 0 41 42 2 0 0 0 0 38 42 1 0 0 0 0 41 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 45 47 1 0 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 46 1 0 0 0 0 45 51 1 1 0 0 0 50 52 1 1 0 0 0 42 53 1 1 0 0 0 52 53 1 1 0 0 0 43 54 1 1 0 0 0 54 55 2 0 0 0 0 54 56 1 0 0 0 0 56 57 1 0 0 0 0 14 58 1 0 0 0 0 43 1 1 6 0 0 0 48 59 1 0 0 0 0 48 60 1 1 0 0 0 59 61 1 0 0 0 0 7 62 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 63 64 2 0 0 0 0 63 65 2 0 0 0 0 63 66 1 0 0 0 0 63 67 1 0 0 0 0 M END > CFN90146 > Vinblastine Sulfate > 143-67-9 > 98% > C46H58N4O9.H2SO4 > 909.06 > Powder > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Vinblastine-Sulfate-CFN90146.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 0.9667 -3.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9667 -3.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5375 -3.8125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8917 -3.3292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5375 -2.8417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4000 -2.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 -3.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -3.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9667 -2.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6958 -2.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4917 -3.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7917 -3.8500 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.3917 -3.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4917 -4.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7917 -2.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6958 -4.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2708 -4.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -5.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0042 -5.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 -5.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -4.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1542 -2.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4417 -2.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7958 -2.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -3.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4542 -1.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3958 -2.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1542 -1.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6958 -2.2000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7917 -4.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1917 -4.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1083 -4.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1917 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7917 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0917 -4.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1083 -5.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7083 -5.7708 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 1 1 0 0 0 0 1 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 2 1 0 0 0 0 1 9 1 1 0 0 0 5 10 1 6 0 0 0 4 11 1 6 0 0 0 12 11 1 0 0 0 0 13 12 1 0 0 0 0 12 14 1 0 0 0 0 11 15 2 0 0 0 0 3 16 1 1 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 6 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 7 1 0 0 0 0 22 26 1 0 0 0 0 24 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 2 30 1 1 0 0 0 30 31 2 0 0 0 0 31 32 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 30 1 0 0 0 0 33 36 1 0 0 0 0 36 37 1 0 0 0 0 M END > CFN97339 > Rocaglamide > 84573-16-0 > 98% > C29H31NO7 > 505.6 > Powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Rocaglamide-CFN97339.html $$$$ -ISIS- 10201511232D 31 34 0 0 0 0 0 0 0 0999 V2000 4.0958 -7.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0958 -8.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 -8.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 -7.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2917 -8.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2917 -7.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -7.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0917 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8958 -7.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6958 -7.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6958 -6.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8958 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0917 -6.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4875 -6.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -10.1917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -10.1917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2958 -7.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0833 -9.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8833 -8.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6833 -9.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 -8.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2917 -6.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -6.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0958 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2958 -6.5083 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3750 -6.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8375 -5.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6833 -10.1792 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 8 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 16 25 1 0 0 0 0 6 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 20 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 23 31 1 0 0 0 0 M END > CFN97083 > Morusin > 62596-29-6 > 98% > C25H24O6 > 420.5 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Morusin-CFN97083.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 3.9875 -6.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -7.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8083 -8.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -7.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -6.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8083 -6.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -6.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -6.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8083 -5.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -5.1917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -4.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6292 -4.7167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 6 9 1 0 0 0 0 7 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 M END > CFN90128 > 2-Carboxybenzaldehyde > 119-67-5 > 98% > C8H6O3 > 150.13 > Cryst. > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-Carboxybenzaldehyde-CFN90128.html $$$$ -ISIS- 10201511232D 20 22 0 0 0 0 0 0 0 0999 V2000 3.4042 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4042 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 -7.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 -5.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -7.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -5.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -5.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5458 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -8.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5458 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -7.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -5.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1167 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1167 -7.3208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0250 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5708 -8.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 -8.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -5.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 7 11 2 0 0 0 0 10 12 2 0 0 0 0 7 12 1 0 0 0 0 12 13 1 0 0 0 0 10 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 13 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 3 19 1 0 0 0 0 14 20 1 1 0 0 0 M END > CFN98947 > 4,9-Dihydroxy-alpha-lapachone > 56473-67-7 > 98% > C15H14O5 > 274.3 > Yellow powder > Quinones > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-9-Dihydroxy-alpha-lapachone-CFN98947.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 2.7333 -8.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7333 -9.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2542 -9.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7708 -9.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7708 -8.7208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2542 -8.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2917 -9.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -9.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -8.7208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2917 -8.4208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3292 -8.4208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3292 -7.8208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8125 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2917 -7.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2125 -9.6208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7708 -8.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3292 -7.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8500 -7.5208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3708 -7.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3708 -8.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8500 -6.9208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3708 -6.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8917 -6.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4083 -6.6208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9292 -6.9208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4500 -6.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4083 -6.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9292 -5.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9292 -7.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3292 -6.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2917 -9.0208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3292 -9.0208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 -8.1208 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 2 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 2 15 2 0 0 0 0 5 16 1 1 0 0 0 12 17 1 1 0 0 0 12 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 11 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 2 0 0 0 0 24 23 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 24 27 1 1 0 0 0 27 28 1 0 0 0 0 25 29 1 0 0 0 0 21 30 1 6 0 0 0 18 21 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 M END > CFN98934 > Stigmasta-4,22-dien-3-one > 55722-32-2 > 98% > C29H46O > 410.7 > Powder > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Stigmasta-4-22-dien-3-one-CFN98934.html $$$$ -ISIS- 10201511232D 12 12 0 0 0 0 0 0 0 0999 V2000 5.2708 -7.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2708 -8.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0917 -8.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9125 -8.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9125 -7.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0917 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7375 -6.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5583 -7.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7375 -6.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4458 -8.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0917 -6.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -8.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 7 9 2 0 0 0 0 2 10 1 0 0 0 0 6 11 1 0 0 0 0 10 12 1 0 0 0 0 M END > CFN98926 > Paeonol > 552-41-0 > 98% > C9H10O3 > 166.2 > Cryst. > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Paeonol-CFN98926.html $$$$ -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 $$$$ -ISIS- 10201511232D 23 26 0 0 0 0 0 0 0 0999 V2000 0.0500 -0.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -1.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5708 -1.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0917 -1.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0917 -0.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5708 -0.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5708 -2.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0917 -2.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6083 -2.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6083 -1.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -2.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -2.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5708 -3.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0917 -2.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1292 -1.1042 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1292 -0.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -0.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4667 -0.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4667 -1.4042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9875 -1.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9875 -0.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4667 -3.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9875 -2.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 3 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 4 1 0 0 0 0 7 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 8 1 0 0 0 0 10 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 1 18 1 0 0 0 0 2 19 1 0 0 0 0 19 20 1 0 0 0 0 18 21 1 0 0 0 0 5 16 1 0 0 0 0 12 22 1 0 0 0 0 22 23 1 0 0 0 0 M END > CFN98904 > Aristolactam BIII > 53948-10-0 > 98% > C18H15NO4 > 309.3 > Yellow powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Aristolactam-BIII-CFN98904.html $$$$ -ISIS- 10201511232D 23 27 0 0 0 0 0 0 0 0999 V2000 3.4125 -5.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4125 -5.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9333 -6.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4542 -5.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4542 -5.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9333 -4.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -6.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4917 -5.7042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4917 -5.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -4.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -6.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9333 -6.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8958 -4.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4917 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0917 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0917 -5.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6125 -6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1333 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1333 -5.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6125 -5.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7042 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -6.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7042 -5.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 3 12 1 0 0 0 0 1 13 1 0 0 0 0 8 14 1 6 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 16 1 0 0 0 0 8 16 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 19 1 0 0 0 0 M END > CFN98869 > Scillascillin > 52706-07-7 > 98% > C17H12O6 > 312.3 > Powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Scillascillin-CFN98869.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4625 -14.5292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4625 -15.4583 0.0000 C 0 0 2 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 2.6542 -14.0625 0.0000 O 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 6 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 1 32 1 6 0 0 0 18 33 1 1 0 0 0 10 34 1 6 0 0 0 4 35 1 6 0 0 0 23 36 1 0 0 0 0 23 37 2 0 0 0 0 M END > CFN98851 > 3-Epicorosolic acid > 52213-27-1 > 98% > C30H48O4 > 472.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-Epicorosolic-acid-CFN98851.html $$$$ -ISIS- 10201511232D 35 38 0 0 0 0 0 0 0 0999 V2000 5.5583 -5.3625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5583 -6.2625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3458 -6.7250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1417 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1417 -5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3458 -4.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6917 -5.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -5.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6917 -6.5500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8208 -6.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8208 -7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6917 -8.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 -7.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5583 -4.4458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5583 -7.1833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3458 -7.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0833 -8.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1417 -8.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1417 -9.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9292 -9.4708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7208 -9.0125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7208 -8.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9292 -7.6417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5083 -7.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9292 -10.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7208 -10.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9292 -6.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5083 -9.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3458 -3.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5583 -3.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1417 -3.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1458 -8.8208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0625 -8.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6917 -9.6167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9333 -3.9917 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 2 0 0 0 0 6 1 1 0 0 0 0 1 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 2 1 0 0 0 0 9 10 1 1 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 9 1 0 0 0 0 1 14 1 1 0 0 0 2 15 1 1 0 0 0 3 16 1 1 0 0 0 11 17 2 0 0 0 0 18 16 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 22 24 1 1 0 0 0 20 25 1 1 0 0 0 25 26 1 0 0 0 0 23 27 1 6 0 0 0 21 28 1 6 0 0 0 6 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 12 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 6 0 0 0 31 35 1 0 0 0 0 M END > CFN98815 > Plumieride > 511-89-7 > 98% > C21H26O12 > 470.4 > Powder > Iridoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Plumieride-CFN98815.html $$$$ -ISIS- 10201511232D 17 18 0 0 0 0 0 0 0 0999 V2000 4.0083 -4.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0083 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8292 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6542 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6542 -4.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8292 -4.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4792 -4.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -4.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -4.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9542 -4.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -4.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -3.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9542 -2.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -3.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1833 -4.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8292 -7.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6042 -2.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 9 1 0 0 0 0 1 15 1 0 0 0 0 3 16 1 0 0 0 0 12 17 1 0 0 0 0 M END > CFN98791 > Resveratrol > 501-36-0 > 98% > C14H12O3 > 228.2 > Powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Resveratrol-CFN98791.html $$$$ -ISIS- 10201511232D 22 24 0 0 0 0 0 0 0 0999 V2000 3.9625 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9625 -7.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7458 -8.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5292 -7.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5292 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7458 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -8.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -7.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -6.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4458 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4458 -5.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -5.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -5.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2292 -5.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -9.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7458 -9.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2292 -6.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0167 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 7 18 2 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 13 21 1 0 0 0 0 21 22 1 0 0 0 0 M END > CFN98785 > Chrysoeriol > 491-71-4 > 98% > C16H12O6 > 300.3 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Chrysoeriol-CFN98785.html $$$$ -ISIS- 10201511232D 20 22 0 0 0 0 0 0 0 0999 V2000 3.1625 -5.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1625 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9625 -6.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7625 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7625 -5.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9625 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5625 -6.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3667 -6.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3667 -5.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5625 -5.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9667 -5.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7667 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7667 -4.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9667 -3.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 -4.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3625 -5.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9625 -7.8167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5625 -7.8167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3625 -6.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 1 17 1 0 0 0 0 3 18 1 0 0 0 0 7 19 2 0 0 0 0 9 11 1 0 0 0 0 2 20 1 0 0 0 0 M END > CFN98783 > Baicalein > 491-67-8 > 98% > C15H10O5 > 270.2 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Baicalein-CFN98783.html $$$$ -ISIS- 10201511232D 41 45 0 0 0 0 0 0 0 0999 V2000 6.1250 -5.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9208 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 -5.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9208 -4.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3208 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3208 -5.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -4.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1250 -4.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -5.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7292 -4.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7292 -3.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1250 -3.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5250 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -7.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9208 -7.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3208 -4.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1250 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1250 -7.4083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3208 -7.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3208 -8.8042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1250 -9.2667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.9292 -8.8042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9292 -7.8708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7292 -7.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7292 -9.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1250 -10.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -9.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 -5.1125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7250 -4.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9292 -5.1125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9292 -6.0375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7250 -6.4875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5250 -6.0375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1292 -6.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1292 -4.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7167 -7.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3208 -6.5000 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 6 0 0 0 24 31 1 6 0 0 0 25 30 1 1 0 0 0 32 20 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 35 38 1 1 0 0 0 34 39 1 6 0 0 0 36 40 1 6 0 0 0 37 41 1 6 0 0 0 M END > CFN98756 > Kaempferitrin > 482-38-2 > 98% > C27H30O14 > 578.5 > Yellow powder > Flavonoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Kaempferitrin-CFN98756.html $$$$ -ISIS- 10201511232D 21 23 0 0 0 0 0 0 0 0999 V2000 3.4000 -5.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -6.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4375 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4375 -5.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -5.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -6.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -6.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -5.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -5.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -5.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5167 -5.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -5.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -4.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5167 -4.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -4.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 -7.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -7.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8792 -5.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5583 -4.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 -4.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 7 17 2 0 0 0 0 3 18 1 0 0 0 0 1 19 1 0 0 0 0 14 20 1 0 0 0 0 20 21 1 0 0 0 0 M END > CFN98744 > Acacetin > 480-44-4 > 98% > C16H12O5 > 284.3 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Acacetin-CFN98744.html $$$$ -ISIS- 10201511232D 22 24 0 0 0 0 0 0 0 0999 V2000 3.1000 -6.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -7.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8833 -7.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -7.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -6.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8833 -5.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4625 -7.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2458 -7.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2458 -6.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4625 -5.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -7.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8250 -7.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8250 -6.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -5.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4625 -4.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4625 -8.5042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0375 -4.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8208 -4.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -5.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -4.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3917 -6.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -7.5958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 8 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 9 1 0 0 0 0 10 15 2 0 0 0 0 7 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 13 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 12 22 1 0 0 0 0 M END > CFN98723 > Damnacanthal > 477-84-9 > 98% > C16H10O5 > 282.3 > Yellow powder > Anthraquinones > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Damnacanthal-CFN98723.html $$$$ -ISIS- 10201511232D 46 51 0 0 0 0 0 0 0 0999 V2000 5.6708 -7.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6708 -8.3667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4458 -8.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2125 -8.3667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2125 -7.4750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4458 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9875 -8.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7625 -8.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7625 -7.4750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9875 -7.0292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5292 -7.0292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5292 -6.1375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7625 -5.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9875 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3042 -5.6917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0792 -6.1375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0792 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2125 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5292 -5.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3042 -4.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5292 -4.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0792 -4.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5292 -3.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0792 -3.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7625 -3.0167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5292 -7.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -8.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -9.2583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3583 -8.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5833 -9.2583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5833 -10.1500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3583 -10.5958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1250 -10.1500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9000 -10.5958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8083 -10.5958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -11.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8083 -8.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -11.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9875 -7.9208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2125 -9.2583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7625 -6.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0792 -5.2458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8458 -5.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6125 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3875 -5.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6125 -7.0208 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 5 18 1 1 0 0 0 12 19 1 1 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 11 26 1 1 0 0 0 2 27 1 1 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 32 33 1 0 0 0 0 33 28 1 0 0 0 0 28 27 1 1 0 0 0 33 34 1 6 0 0 0 31 35 1 1 0 0 0 32 36 1 1 0 0 0 30 37 1 1 0 0 0 36 38 1 0 0 0 0 10 39 1 6 0 0 0 4 40 1 1 0 0 0 9 41 1 1 0 0 0 15 20 1 0 0 0 0 15 42 1 6 0 0 0 16 43 1 1 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 44 46 2 0 0 0 0 M END > CFN98691 > Neritaloside > 465-13-4 > 98% > C32H48O10 > 592.7 > Powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Neritaloside-CFN98691.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 37 41 0 0 0 0 0 0 0 0999 V2000 3.4250 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -7.3208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2833 -7.3208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2833 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5083 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0500 -5.9875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7542 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -5.0958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -9.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -8.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -5.5417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -6.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.1000 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 11 12 1 0 0 0 0 12 13 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 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 22 36 2 0 0 0 0 2 37 2 0 0 0 0 M END > CFN98682 > Betulonic acid > 4481-62-3 > 98% > C30H46O3 > 454.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Betulonic-acid-CFN98682.html $$$$ -ISIS- 10201511232D 20 22 0 0 0 0 0 0 0 0999 V2000 4.0083 -5.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0083 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 -6.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6583 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6583 -5.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 -4.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4792 -6.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -5.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4792 -4.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -6.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -7.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9500 -8.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7750 -7.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7750 -6.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9500 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1875 -4.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4792 -7.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -8.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 -7.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 8 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 1 17 1 0 0 0 0 7 18 2 0 0 0 0 14 19 1 0 0 0 0 3 20 1 0 0 0 0 M END > CFN98681 > Genistein > 446-72-0 > 98% > C15H10O5 > 270.2 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Genistein-CFN98681.html $$$$ -ISIS- 10201511232D 26 30 0 0 0 0 0 0 0 0999 V2000 3.1042 -7.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1042 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8958 -8.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -7.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8958 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4667 -8.3958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2625 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2625 -7.0333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0458 -8.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8417 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8417 -7.0333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0458 -6.5750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6250 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8417 -5.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -5.6625 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.0458 -9.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1667 -5.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -6.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 -7.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4208 -7.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -7.4833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2625 -9.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8417 -9.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 -9.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 4 1 0 0 0 0 8 7 1 0 0 0 0 8 9 1 0 0 0 0 5 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 13 9 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 13 1 0 0 0 0 10 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 9 20 1 1 0 0 0 21 22 1 0 0 0 0 13 23 1 6 0 0 0 18 24 2 0 0 0 0 18 25 1 0 0 0 0 25 26 1 0 0 0 0 12 11 1 0 0 0 0 12 21 1 6 0 0 0 M END > CFN98678 > Tabersonine > 4429-63-4 > 98% > C21H24N2O2 > 336.4 > Yellow powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Tabersonine-CFN98678.html $$$$ -ISIS- 10201511232D 19 21 0 0 0 0 0 0 0 0999 V2000 3.7000 -7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -8.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -9.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2833 -8.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2833 -7.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4917 -7.2958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0750 -9.1208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8667 -8.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8667 -7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -10.0167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1750 -10.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5458 -9.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2833 -6.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -6.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2833 -9.5792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -10.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6333 -10.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4292 -9.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 5 14 1 1 0 0 0 6 15 1 1 0 0 0 4 16 1 6 0 0 0 8 13 1 1 0 0 0 3 17 1 0 0 0 0 7 11 1 6 0 0 0 12 18 2 0 0 0 0 13 19 2 0 0 0 0 M END > CFN98667 > Santamarine > 4290-13-5 > 98% > C15H20O3 > 248.3 > Powder > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Santamarine-CFN98667.html $$$$ -ISIS- 10201511232D 23 26 0 0 0 0 0 0 0 0999 V2000 2.7333 -2.9708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7333 -3.8833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -2.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -3.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8625 -4.1667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4500 -4.4542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3417 -4.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7375 -3.4292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3417 -2.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 -2.4000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2458 -1.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 -5.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 -5.3667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2083 -5.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8083 -5.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -5.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4125 -6.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 -3.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1083 -2.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0208 -2.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 -1.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4958 -4.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6167 -3.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 2 1 0 0 0 0 2 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 1 1 0 0 0 0 10 11 1 1 0 0 0 5 12 1 1 0 0 0 6 13 1 6 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 7 15 1 1 0 0 0 15 16 2 0 0 0 0 14 17 2 0 0 0 0 8 18 1 1 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 2 22 1 1 0 0 0 5 22 1 6 0 0 0 1 23 1 1 0 0 0 10 23 1 6 0 0 0 M END > CFN98630 > Epitulipinolide diepoxide > 39815-40-2 > 98% > C17H22O6 > 322.4 > Powder > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Epitulipinolide-diepoxide-CFN98630.html $$$$ -ISIS- 10201511232D 31 36 0 0 0 0 0 0 0 0999 V2000 0.6083 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6083 -7.3042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4083 -7.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2083 -7.3042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2083 -6.3792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4083 -5.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0083 -7.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -7.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -6.3792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0083 -5.9167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6042 -5.9167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6042 -4.9958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8042 -4.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0083 -4.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4833 -6.2042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0250 -5.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4833 -4.7083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1875 -7.7625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2083 -8.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2083 -5.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -5.4583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 -4.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -3.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6708 -3.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9542 -2.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3375 -2.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4333 -2.2708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1500 -3.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6208 -1.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0083 -6.8417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 -6.8333 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 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 4 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 12 22 1 1 0 0 0 17 23 1 1 0 0 0 23 24 1 0 0 0 0 24 25 2 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 2 0 0 0 0 26 29 2 0 0 0 0 10 30 1 6 0 0 0 11 31 1 1 0 0 0 15 31 1 1 0 0 0 M END > CFN98543 > Resibufogenin > 465-39-4 > 98% > C24H32O4 > 384.51 > Powder > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Resibufogenin-CFN98543.html $$$$ -ISIS- 10201511232D 22 25 0 0 0 0 0 0 0 0999 V2000 3.4958 -7.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -7.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -8.4500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0583 -7.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0583 -7.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -6.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8417 -8.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 -7.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 -7.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8417 -6.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4083 -6.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4083 -5.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 -5.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8417 -5.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -6.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7958 -6.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 -5.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6250 -4.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0583 -5.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 -4.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 13 18 2 0 0 0 0 14 19 2 0 0 0 0 3 20 1 6 0 0 0 3 21 1 1 0 0 0 17 22 1 1 0 0 0 M END > CFN98478 > Cryptotanshinone > 35825-57-1 > 98% > C19H20O3 > 296.4 > Red powder > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Cryptotanshinone-CFN98478.html $$$$ -ISIS- 10201511232D 44 46 0 0 0 0 0 0 0 0999 V2000 0.8250 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -6.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6083 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3917 -6.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3917 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6083 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 -6.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -4.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -3.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -4.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0917 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -5.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -4.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0917 -3.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -4.3167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -6.5750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0917 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -7.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3083 -7.0292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6083 -4.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -3.8625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3917 -3.8625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0417 -5.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0417 -7.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6083 -7.9333 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3917 -8.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -8.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0917 -2.9583 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3083 -2.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -2.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.8625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -5.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 -3.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4208 -9.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 -9.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9875 -9.6542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 -8.3000 0.0000 O 0 0 0 0 0 0 0 0 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 13 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 14 1 0 0 0 0 10 21 1 0 0 0 0 8 22 1 0 0 0 0 12 23 1 0 0 0 0 17 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 6 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 20 35 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 19 38 1 0 0 0 0 18 39 1 0 0 0 0 16 40 1 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 2 0 0 0 0 M END > CFN98529 > Acetate gossypol > 12542-36-8 > 98% > C32H34O10 > 578.61 > Powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Acetate-gossypol-CFN98529.html $$$$ -ISIS- 10201511232D 27 29 0 0 0 0 0 0 0 0999 V2000 4.4500 -8.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -9.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -10.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0083 -9.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0083 -8.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -8.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -10.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5583 -9.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5583 -8.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -8.5042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3375 -8.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1125 -8.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8917 -8.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8917 -7.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1125 -7.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3375 -7.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6625 -7.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -11.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -11.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6708 -8.5042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3375 -10.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -7.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4417 -6.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6708 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2167 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4417 -7.5958 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 8 21 1 0 0 0 0 6 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 17 27 1 0 0 0 0 M END > CFN98527 > Icaritin > 118525-40-9 > 98% > C21H20O6 > 368.38 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Icaritin-CFN98527.html $$$$ -ISIS- 10201511232D 19 21 0 0 0 0 0 0 0 0999 V2000 5.7875 -6.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7875 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5833 -7.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3833 -6.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3833 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5833 -5.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1833 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9792 -6.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9792 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1833 -5.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9875 -5.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1875 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1875 -6.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9875 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5833 -4.6583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1833 -4.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -7.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3917 -5.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3917 -7.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 2 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 2 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 1 1 0 0 0 0 6 15 2 0 0 0 0 10 16 1 0 0 0 0 8 17 1 0 0 0 0 12 18 1 0 0 0 0 13 19 1 0 0 0 0 M END > CFN98468 > Norathyriol > 3542-72-1 > 98% > C13H8O6 > 260.2 > Yellow powder > Xanthones > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Norathyriol-CFN98468.html $$$$ -ISIS- 10201511232D 23 25 0 0 0 0 0 0 0 0999 V2000 3.7458 -4.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -5.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5333 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -5.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -4.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5333 -4.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1125 -5.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -5.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -4.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1125 -4.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6917 -5.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9583 -5.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1708 -5.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1708 -4.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5333 -6.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -7.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -8.1625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1125 -8.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1125 -9.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -8.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5333 -8.6208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5333 -3.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -2.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 2 0 0 0 0 12 2 1 0 0 0 0 13 12 1 0 0 0 0 13 14 2 0 0 0 0 14 1 1 0 0 0 0 15 3 1 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 19 18 1 0 0 0 0 18 20 2 0 0 0 0 17 21 1 6 0 0 0 6 22 1 0 0 0 0 22 23 1 0 0 0 0 M END > CFN98462 > Neobyakangelicol > 35214-82-5 > 98% > C17H16O6 > 316.3 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Neobyakangelicol-CFN98462.html $$$$ -ISIS- 10201511232D 28 30 0 0 0 0 0 0 0 0999 V2000 4.6292 -5.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6292 -6.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2125 -6.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2125 -5.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0042 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7958 -6.1208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7958 -5.2042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0042 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0042 -7.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2125 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2125 -8.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0042 -9.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7958 -8.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7958 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2000 -5.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6625 -4.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9000 -4.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7958 -7.0333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8375 -4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8375 -6.5750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 -5.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7958 -4.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0042 -10.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5875 -9.3167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5875 -10.2292 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 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 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 7 11 1 0 0 0 0 9 19 1 0 0 0 0 8 17 1 0 0 0 0 8 21 1 1 0 0 0 1 22 1 0 0 0 0 2 23 1 0 0 0 0 22 24 1 0 0 0 0 9 25 1 6 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 27 28 1 0 0 0 0 M END > CFN98454 > Nortrachelogenin > 34444-37-6 > 98% > C20H22O7 > 374.4 > Powder > Lignans > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Nortrachelogenin-CFN98454.html $$$$ -ISIS- 10201511232D 36 41 0 0 0 0 0 0 0 0999 V2000 3.1875 -7.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1875 -8.6792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9875 -9.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7875 -8.6792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7875 -7.7542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9875 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5833 -9.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3833 -8.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3833 -7.7542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5833 -7.2958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1833 -7.2958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1833 -6.3708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3833 -5.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5833 -6.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -5.9125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7792 -6.3708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7792 -7.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -4.9875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5792 -5.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5792 -4.9875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7875 -6.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1833 -5.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -9.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0375 -4.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4667 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 -4.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3583 -4.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8208 -4.1875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.6208 -4.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -6.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5833 -8.2167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1833 -8.2167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3833 -6.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7875 -9.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7792 -5.4500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1750 -4.5292 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 19 20 1 0 0 0 0 20 18 1 0 0 0 0 5 21 1 1 0 0 0 12 22 1 1 0 0 0 2 23 1 1 0 0 0 20 24 1 6 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 28 27 1 0 0 0 0 28 29 1 6 0 0 0 20 25 1 1 0 0 0 15 30 1 6 0 0 0 15 18 1 0 0 0 0 10 31 1 6 0 0 0 11 32 1 6 0 0 0 9 33 1 1 0 0 0 4 34 1 6 0 0 0 16 35 1 6 0 0 0 16 19 1 0 0 0 0 18 36 1 6 0 0 0 M END > CFN98501 > Tigogenin > 77-60-1 > 98% > C27H44O3 > 416.64 > Powder > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sisalagenin-CFN98501.html $$$$ -ISIS- 10201511232D 39 42 0 0 0 0 0 0 0 0999 V2000 9.1833 -5.5083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1833 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -6.8708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7667 -6.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7667 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -5.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3958 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3958 -5.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -7.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8125 -5.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0208 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1458 -6.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -4.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1833 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7667 -3.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1833 -8.2375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3958 -7.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 -8.2375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6000 -9.1625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3958 -9.6208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1833 -9.1625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9750 -9.6208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3958 -10.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8125 -9.6208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8125 -7.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1833 -4.5875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5625 -4.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.4167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2417 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4458 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6542 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6542 -7.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4458 -8.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2417 -7.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8667 -8.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8667 -6.4167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8125 -6.8708 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 11 14 2 0 0 0 0 6 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 9 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 23 24 1 6 0 0 0 22 25 1 1 0 0 0 21 26 1 6 0 0 0 20 27 1 1 0 0 0 1 28 1 1 0 0 0 17 29 1 0 0 0 0 13 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 2 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 34 37 1 0 0 0 0 33 38 1 0 0 0 0 39 27 1 0 0 0 0 30 39 1 6 0 0 0 M END > CFN98417 > Fraxamoside > 326594-34-7 > 98% > C25H30O13 > 538.5 > Powder > Iridoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Fraxamoside-CFN98417.html $$$$ -ISIS- 10201511232D 26 28 0 0 0 0 0 0 0 0999 V2000 8.6583 -7.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0333 -7.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2042 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8500 -7.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -8.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2042 -8.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4875 -8.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 -8.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8417 -7.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4875 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8500 -8.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8417 -8.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 -9.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3042 -9.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -9.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3917 -9.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8500 -5.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -5.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2958 -5.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0333 -5.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3542 -10.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8500 -8.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9458 -7.3625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2042 -5.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 1 1 0 0 0 0 2 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 2 1 0 0 0 0 6 13 1 0 0 0 0 9 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 13 17 1 0 0 0 0 17 18 1 0 0 0 0 4 19 1 0 0 0 0 3 20 1 0 0 0 0 19 21 1 0 0 0 0 12 22 1 0 0 0 0 18 23 1 0 0 0 0 16 23 1 0 0 0 0 5 25 1 0 0 0 0 20 26 1 0 0 0 0 16 24 2 0 0 0 0 M END > CFN98413 > Myricanone > 32492-74-3 > 98% > C21H24O5 > 356.4 > Powder > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Myricanone-CFN98413.html $$$$ -ISIS- 10201511232D 22 23 0 0 0 0 0 0 0 0999 V2000 0.5667 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5667 -7.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3417 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1292 -7.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1292 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3417 -6.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2167 -8.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9083 -6.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6875 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -6.3750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2500 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0292 -6.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8125 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5917 -6.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3667 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3667 -7.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1542 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1542 -6.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -8.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -5.4708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 18 21 1 0 0 0 0 10 22 1 6 0 0 0 M END > CFN98383 > Centrolobol > 30359-01-4 > 98% > C19H24O3 > 300.4 > Oil > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Centrolobol-CFN98383.html $$$$ -ISIS- 10201511232D 56 62 0 0 0 0 0 0 0 0999 V2000 6.3125 -6.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -7.4708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0625 -7.9000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8125 -7.4708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8125 -6.6083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0625 -6.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -7.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -7.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -6.6083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5542 -6.1750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0500 -6.1750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0500 -5.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -4.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -5.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7917 -6.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5417 -6.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5417 -5.3125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7917 -4.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5667 -7.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -8.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8125 -5.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -5.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2917 -5.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0500 -7.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -8.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2917 -4.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2917 -4.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5417 -3.5875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7917 -4.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1083 -2.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9708 -2.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3542 -8.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8125 -8.3333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5542 -7.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0375 -5.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2917 -6.6083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -7.4708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8250 -6.6083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -6.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3333 -6.6083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3333 -7.4708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0792 -7.9000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0792 -8.7625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5917 -7.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5917 -6.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3333 -9.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5917 -8.7583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8417 -9.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8417 -10.0500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5917 -10.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3333 -10.0500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0792 -10.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5917 -11.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -8.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -10.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7917 -5.7458 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 28 30 1 1 0 0 0 28 31 1 6 0 0 0 25 32 1 0 0 0 0 4 33 1 6 0 0 0 10 34 1 6 0 0 0 35 23 1 0 0 0 0 23 36 2 0 0 0 0 2 19 1 1 0 0 0 37 19 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 42 43 1 6 0 0 0 41 44 1 1 0 0 0 40 45 1 1 0 0 0 46 43 1 1 0 0 0 46 47 1 0 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 46 1 0 0 0 0 51 52 1 6 0 0 0 50 53 1 6 0 0 0 48 54 1 6 0 0 0 49 55 1 1 0 0 0 18 56 1 1 0 0 0 M END > CFN98325 > alpha-Hederin > 27013-91-8 > 98% > C41H66O12 > 751.0 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/alpha-Hederin-CFN98325.html $$$$ -ISIS- 10201511232D 20 21 0 0 0 0 0 0 0 0999 V2000 7.7625 -5.4375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7625 -6.3542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6292 -6.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1708 -5.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6292 -5.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 -4.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1625 -5.0708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7625 -5.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1625 -6.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -5.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7042 -4.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0833 -5.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8708 -7.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3875 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 -6.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0167 -7.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0167 -5.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -4.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 -7.2667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 1 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 2 1 0 0 0 0 8 11 1 0 0 0 0 7 12 1 1 0 0 0 4 13 2 0 0 0 0 3 14 2 0 0 0 0 15 11 2 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 16 18 2 0 0 0 0 1 5 1 0 0 0 0 2 3 1 0 0 0 0 1 19 1 1 0 0 0 2 20 1 6 0 0 0 M END > CFN98315 > Xanthatin > 26791-73-1 > 98% > C15H18O3 > 246.3 > Powder > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Xanthatin-CFN98315.html $$$$ -ISIS- 10201511232D 88 97 0 0 0 0 0 0 0 0999 V2000 -0.2667 -8.5333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2667 -9.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4250 -9.7250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1167 -9.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1167 -8.5333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4250 -8.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -9.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4875 -9.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4875 -8.5333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8000 -8.1333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1792 -8.1333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1792 -7.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -7.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8625 -8.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -8.1333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5542 -7.3458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8625 -6.9500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9583 -9.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0292 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1167 -7.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4875 -7.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -7.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -8.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -10.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -6.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -5.7542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8625 -6.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -8.9333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1167 -10.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9292 -7.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -8.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6458 -9.3250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6458 -8.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3375 -8.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0292 -8.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0292 -9.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3375 -9.7250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7167 -8.1292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7167 -9.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3375 -10.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8625 -7.7458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1542 -5.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9542 -5.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6208 -10.4167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3375 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0250 -6.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9542 -8.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6917 -10.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -8.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6208 -7.7458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6208 -8.5417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3083 -8.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -8.5417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0000 -7.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3083 -7.3458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6875 -7.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6875 -8.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3083 -6.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -6.1542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6875 -6.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3792 -6.1542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3792 -5.3583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6875 -4.9583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0000 -5.3583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0667 -6.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3125 -4.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6875 -4.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0667 -4.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0667 -4.1625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7583 -3.7625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7583 -2.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0667 -2.5667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3792 -2.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3792 -3.7625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4458 -2.5708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0667 -1.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4458 -4.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4458 -1.7708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.0917 -1.3042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.8458 -0.5458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.0458 -0.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8000 -1.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8458 -1.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6125 -0.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8458 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0750 0.4583 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 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 2 19 1 1 0 0 0 34 19 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 37 40 1 6 0 0 0 38 41 1 1 0 0 0 39 42 1 6 0 0 0 18 43 1 1 0 0 0 28 44 1 1 0 0 0 28 45 1 6 0 0 0 25 46 1 0 0 0 0 36 47 1 1 0 0 0 47 48 1 0 0 0 0 1 49 1 1 0 0 0 20 50 1 0 0 0 0 16 51 1 6 0 0 0 52 32 1 1 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 56 1 0 0 0 0 56 57 1 0 0 0 0 57 52 1 0 0 0 0 56 58 1 1 0 0 0 55 59 1 1 0 0 0 57 60 1 6 0 0 0 61 60 1 1 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 63 67 1 6 0 0 0 66 68 1 6 0 0 0 65 69 1 6 0 0 0 64 70 1 1 0 0 0 71 70 1 6 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 73 77 1 6 0 0 0 74 78 1 1 0 0 0 72 79 1 1 0 0 0 80 77 1 6 0 0 0 80 81 1 0 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 80 1 0 0 0 0 81 85 1 1 0 0 0 82 86 1 1 0 0 0 82 87 1 6 0 0 0 87 88 1 0 0 0 0 M END > CFN98134 > Platycodin D > 58479-68-8 > 98% > C57H92O28 > 1225.33 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Platycodin-D-CFN98134.html $$$$ -ISIS- 10201511232D 27 31 0 0 0 0 0 0 0 0999 V2000 4.6208 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6208 -6.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -7.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1792 -6.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1792 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -5.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7625 -5.4958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2333 -6.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7625 -6.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8833 -7.2333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7583 -7.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1500 -6.2250 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.7583 -5.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8833 -5.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0500 -6.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6333 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2833 -7.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0375 -7.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 -8.1042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4292 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0125 -7.4667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7792 -8.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7792 -9.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -9.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5583 -9.6875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4292 -9.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2083 -9.9042 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 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 2 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 13 14 1 0 0 0 0 14 5 1 0 0 0 0 12 15 1 0 0 0 0 11 16 1 6 0 0 0 15 17 1 0 0 0 0 16 17 1 0 0 0 0 10 19 1 0 0 0 0 19 20 1 0 0 0 0 18 20 2 0 0 0 0 10 21 1 6 0 0 0 19 22 1 1 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 23 25 2 0 0 0 0 11 18 1 0 0 0 0 20 26 1 0 0 0 0 26 27 1 0 0 0 0 M END > CFN98255 > Acetylcephalotaxine > 24274-60-0 > 98% > C20H23NO5 > 357.4 > Powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Acetylcephalotaxine-CFN98255.html $$$$ -ISIS- 10201511232D 21 22 0 0 0 0 0 0 0 0999 V2000 2.7333 -2.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7333 -3.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8625 -2.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -3.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8625 -4.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 -4.4542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3417 -4.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7375 -3.4292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3417 -2.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 -2.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2458 -1.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 -5.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 -5.3667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2083 -5.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8083 -5.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -5.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4125 -6.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 -3.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1083 -2.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0208 -2.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 -1.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 2 2 0 0 0 0 2 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 1 2 0 0 0 0 10 11 1 0 0 0 0 5 12 1 0 0 0 0 6 13 1 6 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 7 15 1 1 0 0 0 15 16 2 0 0 0 0 14 17 2 0 0 0 0 8 18 1 1 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 M END > CFN98252 > Epitulipinolide > 24164-13-4 > 98% > C17H22O4 > 290.4 > Powder > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Epitulipinolide-CFN98252.html $$$$ -ISIS- 10201511232D 19 18 0 0 0 0 0 0 0 0999 V2000 2.3542 -7.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9125 -7.9958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6917 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9125 -8.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4708 -7.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 -6.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0292 -6.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8083 -5.7458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5875 -6.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4875 -6.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8083 -4.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2667 -5.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0458 -6.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0458 -7.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2667 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4875 -7.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7083 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9292 -7.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 2 1 0 0 0 0 4 3 1 0 0 0 0 4 6 3 0 0 0 0 6 7 1 0 0 0 0 7 8 3 0 0 0 0 8 9 1 0 0 0 0 10 9 1 0 0 0 0 10 11 2 0 0 0 0 11 13 1 0 0 0 0 14 13 1 0 0 0 0 3 5 1 6 0 0 0 9 12 1 1 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 M END > CFN98220 > Falcarindiol > 225110-25-8 > 98% > C17H24O2 > 260.4 > Oil > Lipids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Falcarindiol-CFN98220.html $$$$ -ISIS- 10201511232D 77 86 0 0 0 0 0 0 0 0999 V2000 8.1625 -4.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1625 -5.5417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8750 -5.9542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5917 -5.5417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5917 -4.7167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8750 -4.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3042 -5.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0208 -5.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0208 -4.7167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3042 -4.3042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7375 -4.3042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7375 -3.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0208 -3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3042 -3.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5208 -4.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0083 -3.8917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5208 -3.2208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.8292 -3.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1625 -3.0500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6792 -2.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8583 -2.4667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.9833 -2.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4708 -3.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2917 -3.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1333 -4.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0708 -1.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7375 -2.6500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0208 -3.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -3.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4625 -6.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4458 -5.9542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2875 -6.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.3667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3042 -5.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3083 -4.0208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2750 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9500 -5.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2208 -4.6875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7292 -5.5417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7292 -4.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0167 -4.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 -4.7167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3000 -5.5417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0167 -5.9542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5875 -4.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5875 -5.9542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0167 -6.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0167 -7.6042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3000 -8.0167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3000 -8.8417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0167 -9.2542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7292 -8.8417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7292 -8.0167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5875 -7.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5875 -9.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -9.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0167 -10.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -5.5417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8958 -4.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1917 -4.2833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4667 -4.7125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4667 -5.5417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1917 -5.9708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7500 -5.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1958 -3.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -4.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2042 -6.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4875 -3.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4875 -7.2083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7708 -6.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0583 -7.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0583 -8.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7708 -8.4458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4875 -8.0333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7708 -9.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3458 -8.4417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -8.4417 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 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 16 18 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 17 1 0 0 0 0 19 22 1 1 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 21 26 1 1 0 0 0 12 27 1 1 0 0 0 9 28 1 1 0 0 0 5 29 1 1 0 0 0 3 30 1 1 0 0 0 2 31 1 1 0 0 0 3 32 1 6 0 0 0 4 33 1 6 0 0 0 10 34 1 6 0 0 0 17 35 1 6 0 0 0 21 36 1 6 0 0 0 11 37 1 6 0 0 0 16 38 1 6 0 0 0 37 38 1 0 0 0 0 39 31 1 1 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 42 45 1 1 0 0 0 43 46 1 1 0 0 0 44 47 1 6 0 0 0 48 47 1 6 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 49 54 1 1 0 0 0 50 55 1 1 0 0 0 52 56 1 1 0 0 0 51 57 1 6 0 0 0 58 46 1 1 0 0 0 58 59 1 0 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 58 1 0 0 0 0 62 64 1 1 0 0 0 60 65 1 1 0 0 0 61 66 1 6 0 0 0 63 67 1 6 0 0 0 65 68 1 0 0 0 0 69 67 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 74 1 0 0 0 0 74 69 1 0 0 0 0 73 75 1 1 0 0 0 72 76 1 6 0 0 0 74 77 1 6 0 0 0 M END > CFN98102 > Jujuboside B > 55466-05-2 > 98% > C52H84O21 > 1045.22 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Jujuboside-B-CFN98102.html $$$$ -ISIS- 10201511232D 23 27 0 0 0 0 0 0 0 0999 V2000 3.1000 -4.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -5.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -5.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6792 -5.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6792 -4.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4708 -5.9708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2625 -5.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0542 -5.9708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8458 -5.5125 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.2625 -4.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0542 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8458 -4.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0542 -6.8833 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.8458 -7.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6375 -6.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6375 -5.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8458 -8.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6375 -8.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4292 -8.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4292 -7.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4292 -5.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2625 -7.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 4 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 8 11 2 0 0 0 0 5 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 10 1 0 0 0 0 9 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 10 1 0 0 0 0 15 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 16 1 0 0 0 0 17 22 2 0 0 0 0 14 23 1 0 0 0 0 M END > CFN99993 > Evodiamine > 518-17-2 > 98% > C19H17N3O > 303.36 > Yellow powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Evodiamine-CFN99993.html $$$$ -ISIS- 10201511232D 35 39 0 0 0 0 0 0 0 0999 V2000 3.9458 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9458 -7.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7125 -8.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4875 -7.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4875 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7125 -6.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2625 -8.3292 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.0333 -7.8833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0333 -6.9917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8083 -8.3292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5833 -7.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -6.9917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8083 -6.5458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3583 -6.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -5.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -5.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8083 -5.6542 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.9583 -5.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4375 -6.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2625 -9.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1708 -8.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3958 -7.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -8.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -8.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8083 -7.4375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -7.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1250 -6.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8083 -9.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -9.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -9.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -9.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -8.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1250 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9000 -8.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1250 -9.6708 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 5 1 0 0 0 0 8 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 9 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 13 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 9 19 1 1 0 0 0 7 20 1 0 0 0 0 2 21 1 0 0 0 0 21 22 1 0 0 0 0 8 23 1 1 0 0 0 11 24 1 1 0 0 0 13 25 1 6 0 0 0 12 26 1 6 0 0 0 26 27 1 0 0 0 0 10 28 1 6 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 10 32 1 1 0 0 0 24 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 M END > CFN98083 > Vindoline > 2182-14-1 > 98% > C25H32N2O6 > 456.5 > Powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Vindoline-CFN98083.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 34 38 0 0 0 0 0 0 0 0999 V2000 4.6583 -6.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6583 -7.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4542 -8.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 -7.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2500 -6.8625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4542 -6.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 -8.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8458 -7.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8458 -6.8625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0500 -6.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6417 -6.4042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6417 -5.4833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8458 -5.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 -5.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4375 -5.0208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2333 -5.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2333 -6.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 -5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -4.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4375 -4.1042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8625 -8.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2333 -3.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0333 -4.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8292 -3.6417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.6250 -4.1042 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.4208 -3.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6250 -5.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8292 -2.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1708 -7.7833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -6.8625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2333 -4.5625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -7.3208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8458 -5.9417 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 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 5 18 1 1 0 0 0 12 19 1 1 0 0 0 2 21 1 1 0 0 0 20 22 1 6 0 0 0 23 20 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 27 26 1 0 0 0 0 26 28 1 0 0 0 0 25 29 1 6 0 0 0 4 30 1 6 0 0 0 9 31 1 6 0 0 0 31 30 1 0 0 0 0 15 20 1 0 0 0 0 15 32 1 6 0 0 0 11 33 1 6 0 0 0 10 34 1 6 0 0 0 M END > CFN98035 > Ergosterol peroxide > 2061-64-5 > 98% > C28H44O3 > 428.7 > Cryst. > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ergosterol-peroxide-CFN98035.html $$$$ -ISIS- 10201511232D 20 21 0 0 0 0 0 0 0 0999 V2000 4.1833 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1833 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -5.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -5.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -7.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -5.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -7.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0875 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8625 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6458 -6.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -6.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6458 -5.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8625 -5.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 -5.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 9 5 1 0 0 0 0 7 10 2 0 0 0 0 1 11 1 0 0 0 0 3 12 1 0 0 0 0 8 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 9 20 1 0 0 0 0 M END > CFN99890 > Cardamonin > 19309-14-9 > 98% > C16H14O4 > 270.3 > Yellow powder > Chalcones > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Cardamonin-CFN99890.html $$$$ -ISIS- 10201511232D 24 26 0 0 0 0 0 0 0 0999 V2000 0.1833 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1833 -4.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7042 -4.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2208 -4.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2208 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7042 -3.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7417 -4.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2625 -4.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2625 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7417 -3.3167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7833 -3.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8208 -3.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8208 -2.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 -2.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7833 -2.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7417 -5.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7042 -5.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3375 -3.3167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3417 -2.4167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8583 -2.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8583 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3375 -4.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8583 -4.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 7 17 2 0 0 0 0 3 18 1 0 0 0 0 1 19 1 0 0 0 0 14 20 1 0 0 0 0 20 21 1 0 0 0 0 19 22 1 0 0 0 0 2 23 1 0 0 0 0 23 24 1 0 0 0 0 M END > CFN99883 > Salvigenin > 19103-54-9 > 98% > C18H16O6 > 328.3 > Yellow powder > Flavonoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Salvigenin-CFN99883.html $$$$ -ISIS- 10201511232D 42 47 0 0 0 0 0 0 0 0999 V2000 8.3375 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3375 -7.2167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0167 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6917 -7.2167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6917 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0167 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3708 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0500 -7.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0500 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3708 -6.0417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7250 -6.0417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7250 -5.2583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0500 -4.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3708 -5.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4083 -4.8667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.0792 -5.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0792 -6.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4083 -4.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -3.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0792 -3.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -2.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0792 -2.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -4.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6917 -5.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 -6.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6917 -8.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 -7.6083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9750 -8.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3000 -7.6083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6208 -8.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6208 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3000 -9.1750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9750 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9458 -7.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -9.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -9.9542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9750 -10.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3708 -6.8250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0458 -2.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0833 -4.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0500 -5.6500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 -9.1750 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 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 15 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 22 1 0 0 0 0 12 23 1 1 0 0 0 5 24 1 1 0 0 0 11 25 1 1 0 0 0 4 26 1 1 0 0 0 2 27 1 1 0 0 0 28 27 1 1 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 32 33 1 0 0 0 0 33 28 1 0 0 0 0 30 34 1 1 0 0 0 31 35 1 1 0 0 0 32 36 1 1 0 0 0 36 37 1 0 0 0 0 10 38 1 6 0 0 0 21 39 2 0 0 0 0 15 40 1 6 0 0 0 9 41 1 1 0 0 0 33 42 1 6 0 0 0 M END > CFN99868 > Odoroside H > 18810-25-8 > 98% > C30H46O8 > 534.7 > Powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Odoroside-H-CFN99868.html $$$$ -ISIS- 10201511232D 10 10 0 0 0 0 0 0 0 0999 V2000 2.1542 -6.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1542 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9375 -8.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7208 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7208 -6.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9375 -6.1875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3708 -6.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3708 -8.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5042 -6.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5042 -8.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 7 1 0 0 0 0 2 8 1 0 0 0 0 5 9 1 0 0 0 0 4 10 1 0 0 0 0 M END > CFN99909 > Tetramethylpyrazine > 1124-11-4 > 98% > C8H12N2 > 136.20 > Powder > Miscellaneous > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Tetramethylpyrazine-CFN99909.html $$$$ -ISIS- 10201511232D 12 14 0 0 0 0 0 0 0 0999 V2000 5.6875 -6.1875 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6875 -7.1250 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5792 -7.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1333 -6.6583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5792 -5.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 -6.1875 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7500 -7.1250 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0833 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0833 -7.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0833 -5.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -5.0042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -8.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 1 1 0 0 0 0 1 6 1 0 0 0 0 2 7 1 0 0 0 0 6 8 1 0 0 0 0 7 9 1 0 0 0 0 8 9 1 0 0 0 0 6 10 1 0 0 0 0 10 7 1 0 0 0 0 5 11 2 0 0 0 0 3 12 2 0 0 0 0 M END > CFN99791 > Norcantharidin > 5442-12-6 > 98% > C8H8O4 > 168.15 > White powder > Monoterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Norcantharidin-CFN99791.html $$$$ -ISIS- 10201511232D 42 46 0 0 0 0 0 0 0 0999 V2000 2.8458 -8.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -8.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6042 -9.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3583 -8.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3583 -8.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6042 -7.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -9.3125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8750 -8.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8750 -8.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1167 -7.5667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6042 -10.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3583 -9.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -6.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -9.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -10.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -10.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -11.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3875 -8.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1458 -9.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3875 -8.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -10.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -6.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -5.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1458 -10.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9042 -10.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6583 -10.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6583 -9.3125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9042 -8.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -11.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -12.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -13.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -12.8083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -11.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 -7.2708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -7.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7167 -8.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -8.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -4.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -4.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -4.0667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 -4.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3875 -3.6292 0.0000 O 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 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 3 11 1 0 0 0 0 4 12 1 6 0 0 0 10 13 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 14 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 16 21 2 0 0 0 0 13 22 2 0 0 0 0 22 23 1 0 0 0 0 19 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 19 1 0 0 0 0 17 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 33 17 1 0 0 0 0 5 34 1 1 0 0 0 7 15 1 6 0 0 0 8 14 1 1 0 0 0 9 35 1 1 0 0 0 9 36 1 6 0 0 0 10 37 1 6 0 0 0 23 38 1 0 0 0 0 23 39 2 0 0 0 0 38 40 1 0 0 0 0 39 41 1 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 M END > CFN99832 > Scutebarbatine A > 176520-13-1 > 98% > C32H34N2O7 > 558.6 > Powder > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Scutebarbatine-A-CFN99832.html $$$$ -ISIS- 10201511232D 23 25 0 0 0 0 0 0 0 0999 V2000 4.0542 -6.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -7.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8542 -8.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6542 -7.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6542 -6.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8542 -6.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2542 -7.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2542 -6.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -6.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -6.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -5.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2542 -4.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4542 -5.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8542 -4.8292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6542 -5.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8542 -3.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6542 -5.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3167 -8.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6542 -8.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3917 -8.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4708 -8.8625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8542 -9.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 10 1 0 0 0 0 12 15 1 0 0 0 0 5 16 1 1 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 3 19 1 1 0 0 0 4 20 1 6 0 0 0 3 21 1 6 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 M END > CFN99822 > Dehydroabietic acid > 1740-19-8 > 98% > C20H28O2 > 300.4 > Powder > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Dehydroabietic-acid-CFN99822.html $$$$ -ISIS- 10201511232D 18 20 0 0 0 0 0 0 0 0999 V2000 3.2167 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2167 -7.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 -7.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8333 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -7.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2542 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0667 -7.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0667 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2542 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -4.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -8.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8708 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8708 -7.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 8 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 9 1 0 0 0 0 10 15 2 0 0 0 0 7 16 2 0 0 0 0 13 17 1 0 0 0 0 12 18 1 0 0 0 0 M END > CFN99810 > 2-Hydroxy-3-methylanthraquinone > 17241-40-6 > 98% > C15H10O3 > 238.2 > Yellow powder > Anthraquinones > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-Hydroxy-3-methylanthraquinone-CFN99810.html $$$$ -ISIS- 10201511232D 34 38 0 0 0 0 0 0 0 0999 V2000 3.9208 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -9.2333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7167 -9.6917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5083 -9.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5083 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7167 -7.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -9.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3000 -7.8583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8875 -7.8583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8875 -6.9417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0958 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -6.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6833 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4750 -7.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4750 -6.9417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6833 -6.4833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2708 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2708 -5.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4750 -5.1083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6833 -5.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -9.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9333 -4.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0167 -4.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2708 -7.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8875 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -10.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7167 -10.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6833 -7.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -7.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -7.4000 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 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 18 1 0 0 0 0 12 24 1 6 0 0 0 21 25 1 6 0 0 0 21 26 1 1 0 0 0 17 27 1 1 0 0 0 11 28 1 1 0 0 0 10 29 1 1 0 0 0 4 30 1 1 0 0 0 3 31 1 1 0 0 0 18 32 1 1 0 0 0 5 33 1 6 0 0 0 9 34 1 6 0 0 0 2 23 1 1 0 0 0 M END > CFN99806 > Epifriedelanol > 16844-71-6 > 98% > C30H52O > 428.7 > Cryst. > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Epifriedelanol-CFN99806.html $$$$ -ISIS- 10201511232D 19 21 0 0 0 0 0 0 0 0999 V2000 3.7083 -8.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7083 -9.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4958 -9.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2875 -9.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2875 -8.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4958 -7.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 -9.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 -8.1625 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3875 -10.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5167 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9708 -6.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5167 -5.7958 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6083 -5.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9708 -8.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3958 -5.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 7 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 11 2 0 0 0 0 12 17 2 0 0 0 0 14 18 1 0 0 0 0 14 19 1 0 0 0 0 M END > CFN99670 > Catalpalactone > 1585-68-8 > 98% > C15H14O4 > 258.3 > Powder > Sesquiterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Catalpalactone-CFN99670.html $$$$ -ISIS- 10201511232D 18 20 0 0 0 0 0 0 0 0999 V2000 3.4042 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4042 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 -7.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 -5.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -7.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -5.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -5.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5458 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -8.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5458 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -7.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -5.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1167 -6.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1167 -7.3208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0250 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5708 -8.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 7 11 2 0 0 0 0 10 12 2 0 0 0 0 7 12 1 0 0 0 0 12 13 1 0 0 0 0 10 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 13 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 M END > CFN99641 > Dehydro-alpha-lapachone > 15297-92-4 > 98% > C15H12O3 > 240.3 > Orange powder > Quinones > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Dehydro-alpha-lapachone-CFN99641.html $$$$ -ISIS- 10201511232D 22 25 0 0 0 0 0 0 0 0999 V2000 6.5583 -7.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5583 -7.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -8.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1792 -7.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1792 -7.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -6.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9875 -8.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8000 -7.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8000 -7.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9875 -6.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -6.5875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6500 -5.6583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7333 -5.4625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2667 -6.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8917 -6.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3292 -6.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3583 -4.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -8.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9375 -7.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6083 -8.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -4.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4083 -5.9250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 11 1 0 0 0 0 2 18 1 0 0 0 0 18 19 1 0 0 0 0 8 20 2 0 0 0 0 13 17 1 6 0 0 0 12 17 1 6 0 0 0 13 21 1 1 0 0 0 11 1 1 0 0 0 0 11 22 1 6 0 0 0 14 16 2 0 0 0 0 M END > CFN99629 > Micromelin > 15085-71-9 > 98% > C15H12O6 > 288.3 > Powder > Coumarins > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Micromelin-CFN99629.html $$$$ -ISIS- 10201511232D 25 26 0 0 0 0 0 0 0 0999 V2000 6.3542 -5.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3542 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -7.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8375 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8375 -5.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -5.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5792 -7.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3208 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0625 -7.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8042 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5458 -7.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2875 -6.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2875 -5.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5458 -5.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8042 -5.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6167 -5.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0250 -5.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5792 -7.8667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5458 -7.8667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2875 -8.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5458 -4.4458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8042 -4.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0625 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9708 -3.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4000 -4.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 4 1 0 0 0 0 8 7 1 0 0 0 0 9 8 2 0 0 0 0 10 9 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 10 1 0 0 0 0 1 16 1 0 0 0 0 13 17 1 0 0 0 0 7 18 2 0 0 0 0 11 19 1 0 0 0 0 19 20 1 0 0 0 0 14 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 21 24 1 1 0 0 0 21 25 1 6 0 0 0 M END > CFN99575 > Licochalcone A > 58749-22-7 > 98% > C21H22O4 > 338.40 > Yellow powder > Chalcones > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Licochalcone-A-CFN99575.html $$$$ -ISIS- 10201511232D 47 52 0 0 0 0 0 0 0 0999 V2000 6.5708 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 -8.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2875 -8.4750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0000 -8.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0000 -7.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2875 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -7.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7167 -6.8208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1500 -6.8208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1500 -5.9917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4333 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -5.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5833 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5833 -5.9917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8542 -8.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -9.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3000 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -7.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 -9.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -4.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3000 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3000 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -4.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -8.8875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -7.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -5.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -6.4083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4208 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9875 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -7.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2708 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5542 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5542 -9.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2708 -9.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9875 -9.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8375 -9.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0167 -5.9917 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 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 18 26 1 0 0 0 0 17 27 1 0 0 0 0 27 28 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 6 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 36 19 1 0 0 0 0 37 36 1 0 0 0 0 37 38 2 0 0 0 0 38 39 1 0 0 0 0 36 40 2 0 0 0 0 39 41 2 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 43 44 1 0 0 0 0 44 45 2 0 0 0 0 45 39 1 0 0 0 0 43 46 1 0 0 0 0 23 47 1 0 0 0 0 M END > CFN99486 > 3-O-(E)-p-Coumaroylbetulin > 144424-80-6 > 98% > C39H56O4 > 588.9 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-O-E-p-Coumaroylbetulin-CFN99486.html $$$$ -ISIS- 10201511232D 20 20 0 0 0 0 0 0 0 0999 V2000 0.0833 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0833 -2.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8792 -3.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -2.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8792 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4667 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2625 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -1.1958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -0.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 -3.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -0.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4375 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2333 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6125 -1.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 1 10 1 0 0 0 0 10 11 1 0 0 0 0 2 12 1 0 0 0 0 9 13 1 0 0 0 0 9 14 2 0 0 0 0 13 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 M END > CFN99531 > 6-Shogaol > 555-66-8 > 98% > C17H24O3 > 276.37 > Oil > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/6-Shogaol-CFN99531.html $$$$ -ISIS- 10201511232D 20 22 0 0 0 0 0 0 0 0999 V2000 5.0917 -5.5458 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 -6.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9125 -6.9625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7292 -6.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7292 -5.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9125 -5.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6292 -6.7833 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.1833 -6.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6292 -5.2542 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9125 -4.1292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6333 -8.0833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3375 -8.9958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8167 -7.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9958 -8.0833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2917 -8.9958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0083 -9.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8167 -9.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1792 -7.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3625 -8.0833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -6.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 5 1 0 0 0 0 6 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 12 1 0 0 0 0 11 7 1 1 0 0 0 12 16 1 6 0 0 0 15 17 1 6 0 0 0 14 18 1 1 0 0 0 18 19 1 0 0 0 0 2 20 2 0 0 0 0 M END > CFN99524 > Crotonoside > 1818-71-9 > 98% > C10H13N5O5 > 283.24 > Powder > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Crotonoside-CFN99524.html $$$$ -ISIS- 10201511232D 78 86 0 0 0 0 0 0 0 0999 V2000 1.4167 -6.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4167 -7.3125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1333 -7.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -6.4875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1333 -6.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5583 -7.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -6.4875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5583 -6.0750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9917 -6.0750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9917 -5.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -4.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5583 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -4.8375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4208 -5.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4208 -6.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -4.0125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1375 -4.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1375 -4.0125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1250 -3.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -5.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -4.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1375 -3.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8542 -3.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5708 -4.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2875 -3.6000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0042 -4.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2875 -2.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7208 -3.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5583 -6.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -5.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4208 -4.4250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4292 -4.0125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4292 -4.8375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.1458 -5.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.8625 -4.8375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8625 -4.0125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.1458 -3.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5792 -3.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1458 -6.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7208 -5.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5792 -5.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2958 -4.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -7.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0167 -7.3125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0167 -6.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7333 -6.0750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4500 -6.4875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4500 -7.3125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7333 -7.7292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7333 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1625 -7.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1625 -6.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7333 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -8.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1625 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8792 -8.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8792 -9.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1625 -10.2042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4500 -9.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5958 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1625 -11.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5958 -10.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7333 -10.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0167 -4.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1625 -5.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4458 -4.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4458 -4.0083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1625 -3.5958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8792 -4.0083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8792 -4.8333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1625 -2.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5917 -3.5958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5917 -5.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7292 -3.5958 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 12 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 6 0 0 0 5 22 1 1 0 0 0 9 23 1 1 0 0 0 12 24 1 1 0 0 0 20 25 1 6 0 0 0 20 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 28 30 1 1 0 0 0 29 31 1 0 0 0 0 10 32 1 6 0 0 0 11 33 1 6 0 0 0 15 34 1 6 0 0 0 16 35 1 6 0 0 0 36 31 1 6 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 40 42 1 6 0 0 0 38 43 1 6 0 0 0 37 44 1 1 0 0 0 39 45 1 1 0 0 0 42 46 1 0 0 0 0 2 47 1 1 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 1 0 0 0 53 57 1 6 0 0 0 58 57 1 1 0 0 0 58 59 1 0 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 58 1 0 0 0 0 60 64 1 6 0 0 0 62 65 1 6 0 0 0 61 66 1 1 0 0 0 63 67 1 6 0 0 0 54 68 1 0 0 0 0 69 56 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 74 1 0 0 0 0 74 69 1 0 0 0 0 72 75 1 1 0 0 0 73 76 1 6 0 0 0 74 77 1 6 0 0 0 71 78 1 6 0 0 0 M END > CFN99517 > Protodioscin > 55056-80-9 > 98% > C51H84O22 > 1049.21 > Powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Protodioscin-CFN99517.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 $$$$ -ISIS- 10201511232D 24 27 0 0 0 0 0 0 0 0999 V2000 4.1917 -11.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7958 -10.6917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0750 -11.7542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8125 -11.2083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8125 -10.2917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0750 -9.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1917 -9.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 -11.6625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3958 -11.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3958 -10.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 -9.8333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6083 -12.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8125 -13.0375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0625 -12.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -13.9542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3958 -13.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8792 -10.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 -8.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 -9.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3958 -12.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8958 -11.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6792 -10.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2792 -12.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0167 -14.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 2 1 0 0 0 0 4 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 5 1 0 0 0 0 8 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 1 0 0 0 12 16 1 1 0 0 0 2 17 1 1 0 0 0 11 18 1 6 0 0 0 5 19 1 6 0 0 0 8 20 1 6 0 0 0 4 21 1 6 0 0 0 2 22 1 6 0 0 0 22 21 1 0 0 0 0 3 23 1 1 0 0 0 3 14 1 0 0 0 0 15 24 1 0 0 0 0 M END > CFN99184 > Artemether > 71963-77-4 > 98% > C16H26O5 > 298.38 > White powder > Sesquiterpenes > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Artemether-CFN99184.html $$$$ -ISIS- 10201511232D 21 22 0 0 0 0 0 0 0 0999 V2000 1.7708 -5.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -5.4917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1958 -5.0167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6125 -5.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6125 -6.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1958 -6.8958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9750 -6.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1958 -7.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4083 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -5.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 -6.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4083 -6.8625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5625 -5.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 -5.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -5.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -6.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7417 -5.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -5.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5333 -6.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 2 1 0 0 0 0 6 8 1 1 0 0 0 4 9 1 1 0 0 0 9 10 1 0 0 0 0 7 11 1 6 0 0 0 5 12 1 6 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 18 21 1 0 0 0 0 M END > CFN99177 > Salidroside > 10338-51-9 > 98% > C14H20O7 > 300.30 > Powder > Phenols > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Salidroside-CFN99177.html $$$$ -ISIS- 10201511232D 48 54 0 0 0 0 0 0 0 0999 V2000 -1.6417 -0.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6417 -1.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8708 -1.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -1.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -0.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8708 0.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4208 0.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1958 -0.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1958 -1.0625 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 -2.4208 -1.5083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9667 -1.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 0.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -1.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -0.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -1.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -1.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 -1.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 -0.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 0.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 -1.5083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7500 -1.0625 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.7500 -0.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 0.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8792 0.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 -2.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 -2.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -2.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6542 -2.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6542 -3.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -4.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 -3.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4208 -2.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -2.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -3.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8708 -4.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -3.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -2.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8708 -2.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0792 -3.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3333 -2.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -4.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1083 -0.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4542 -1.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4542 -0.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5208 -1.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1958 -1.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 -1.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -5.1333 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 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 2 1 0 0 0 0 9 11 1 0 0 0 0 5 12 1 0 0 0 0 4 13 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 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 14 24 1 0 0 0 0 20 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 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 26 1 0 0 0 0 10 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 38 33 1 0 0 0 0 29 39 1 0 0 0 0 37 39 1 0 0 0 0 15 40 1 0 0 0 0 3 40 1 0 0 0 0 36 41 1 0 0 0 0 24 42 1 0 0 0 0 13 43 1 0 0 0 0 12 44 1 0 0 0 0 21 45 1 0 0 0 0 10 46 1 1 0 0 0 20 47 1 6 0 0 0 41 48 1 0 0 0 0 M END > CFN99166 > Tetrandrine > 518-34-3 > 98% > C38H42N2O6 > 622.76 > Cryst. > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Tetrandrine-CFN99166.html $$$$ -ISIS- 10201511232D 14 14 0 0 0 0 0 0 0 0999 V2000 3.2583 -8.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2583 -9.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -10.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8542 -9.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8542 -8.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 -8.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2417 -8.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0417 -8.6375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2417 -7.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4625 -10.0167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4625 -8.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6625 -9.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 9 11 2 0 0 0 0 2 12 1 0 0 0 0 1 13 1 0 0 0 0 12 14 1 0 0 0 0 M END > CFN99135 > 3-Hydroxy-4-methoxycinnamic acid > 537-73-5 > 98% > C10H10O4 > 194.18 > Powder > Phenylpropanoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-Hydroxy-4-methoxycinnamic-acid-CFN99135.html $$$$ -ISIS- 10201511232D 31 35 0 0 0 0 0 0 0 0999 V2000 4.3958 -2.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -3.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -3.7250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9625 -3.2750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9625 -2.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1833 -1.9167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1833 -4.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -5.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -5.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 -5.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 -5.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -7.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7542 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7542 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6208 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6208 -7.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6125 -1.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -2.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -3.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6125 -3.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -2.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4417 -2.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -3.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8292 -3.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3625 -2.8208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8292 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1083 -4.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 -1.4667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 -4.1792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -1.0125 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 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 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 2 0 0 0 0 12 7 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 9 16 1 0 0 0 0 16 17 1 0 0 0 0 1 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 2 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 20 1 0 0 0 0 25 4 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 5 27 1 0 0 0 0 25 28 2 0 0 0 0 5 29 1 6 0 0 0 4 30 1 1 0 0 0 6 31 1 1 0 0 0 M END > CFN99128 > 4'-Demethylepipodophyllotoxin > 6559-91-7 > 98% > C21H20O8 > 400.38 > White powder > Lignans > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/4-Demethylepipodophyllotoxin-CFN99128.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4625 -8.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -9.8792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2625 -10.3417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0708 -9.8792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0708 -8.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2625 -8.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -10.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -9.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -8.4833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4875 -8.4833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4875 -7.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -7.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -8.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -8.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.5500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -7.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -10.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -11.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0708 -8.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9083 -8.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4875 -9.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -11.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9083 -7.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9083 -6.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -5.6917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -6.1542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1042 -4.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8333 -5.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0708 -10.8083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.4125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -8.0167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9083 -8.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -7.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -6.1542 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 6 0 0 0 29 31 1 1 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 18 34 1 1 0 0 0 23 35 2 0 0 0 0 23 36 1 0 0 0 0 2 19 1 1 0 0 0 29 37 1 6 0 0 0 M END > CFN99433 > Pomolic acid > 13849-91-7 > 98% > C30H48O4 > 472.7 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Pomolic-acid-CFN99433.html $$$$ -ISIS- 10201511232D 40 44 0 0 0 0 0 0 0 0999 V2000 5.9583 -6.8167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9583 -7.7167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7375 -8.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5167 -7.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5167 -6.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7375 -6.3667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -8.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 -7.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 -6.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -6.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7375 -5.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5167 -5.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5167 -4.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7375 -3.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9583 -4.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9583 -5.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -6.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5750 -7.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -7.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6792 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3125 -8.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8417 -8.9083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7375 -8.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5833 -8.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1125 -9.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2292 -6.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -5.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8583 -6.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6375 -6.8167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8583 -8.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -9.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5167 -9.5167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8583 -5.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 -9.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9583 -5.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4792 -10.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -7.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2917 -9.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5625 -10.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9583 -8.6167 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 2 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 2 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 1 17 1 0 0 0 0 17 18 1 0 0 0 0 19 2 1 0 0 0 0 18 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 19 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 25 22 1 0 0 0 0 20 26 2 0 0 0 0 10 27 1 0 0 0 0 9 28 1 0 0 0 0 28 29 1 0 0 0 0 8 30 1 0 0 0 0 7 31 1 0 0 0 0 31 32 1 0 0 0 0 28 33 2 0 0 0 0 31 34 2 0 0 0 0 25 36 1 1 0 0 0 25 39 1 6 0 0 0 21 37 1 1 0 0 0 22 38 1 6 0 0 0 2 40 1 1 0 0 0 1 35 1 6 0 0 0 6 11 1 1 0 0 0 M END > CFN99321 > Psidial A > 1207181-35-8 > 98% > C30H34O5 > 474.6 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Psidial-A-CFN99321.html $$$$ -ISIS- 10201511232D 20 23 0 0 0 0 0 0 0 0999 V2000 2.7083 -1.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7083 -2.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 -2.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -2.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -1.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 -1.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 -2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -3.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -2.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7083 -3.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7083 -3.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 -4.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -3.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7875 -2.0875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7875 -1.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3042 -1.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1875 -1.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1875 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -1.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 3 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 4 1 0 0 0 0 7 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 8 1 0 0 0 0 10 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 1 18 1 0 0 0 0 2 19 1 0 0 0 0 5 16 1 0 0 0 0 18 20 1 0 0 0 0 M END > CFN99222 > Aristolactam FI > 112501-42-5 > 98% > C16H11NO3 > 265.3 > Yellow powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Aristolactam-FI-CFN99222.html $$$$ -ISIS- 10201511232D 33 36 0 0 0 0 0 0 0 0999 V2000 2.6250 -6.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 -7.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4125 -8.2417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2000 -7.7875 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2000 -6.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4125 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9875 -8.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -7.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -6.8792 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9875 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5583 -6.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5583 -5.5167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7708 -5.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9875 -5.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -6.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9583 -5.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -5.2375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8417 -8.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7042 -4.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0958 -3.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5875 -4.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1917 -4.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0792 -4.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6833 -5.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5667 -5.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1750 -5.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8458 -4.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5583 -4.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -5.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9583 -9.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8667 -9.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 -6.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5583 -7.3333 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 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 3 31 1 6 0 0 0 24 32 1 0 0 0 0 11 33 1 6 0 0 0 M END > CFN99083 > Coccinic acid > 107783-45-9 > 98% > C30H46O3 > 454.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Coccinic-acid-CFN99083.html $$$$ -ISIS- 10201511232D 19 19 0 0 0 0 0 0 0 0999 V2000 4.2042 -7.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2042 -8.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0083 -9.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8083 -8.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8083 -7.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0083 -7.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6125 -7.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6125 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4167 -5.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2167 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2167 -7.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0208 -7.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0208 -8.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2167 -9.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8250 -9.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -4.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -4.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 -4.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -9.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 1 0 0 0 0 13 12 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 9 16 1 6 0 0 0 9 17 1 1 0 0 0 16 18 2 0 0 0 0 2 19 1 0 0 0 0 M END > CFN99047 > Bakuchiol > 10309-37-2 > 98% > C18H24O > 256.4 > Oil > Phenols > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Bakuchiol-CFN99047.html $$$$ -ISIS- 10201511232D 26 31 0 0 0 0 0 0 0 0999 V2000 3.0250 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -7.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8167 -7.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6125 -7.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6125 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8167 -6.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4042 -7.9708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -7.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -6.6000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9833 -7.9708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1917 -5.6833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7542 -5.0208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9833 -5.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -4.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1042 -6.6000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5625 -5.8000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5625 -4.6208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2083 -7.0708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2083 -5.5375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2083 -7.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9958 -8.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -5.8000 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.8208 -5.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -6.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0042 -5.0833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2792 -5.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 8 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 1 0 0 0 9 15 1 6 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 14 1 0 0 0 0 12 14 1 0 0 0 0 15 18 1 0 0 0 0 17 19 1 0 0 0 0 19 13 1 1 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 18 24 1 0 0 0 0 19 25 1 1 0 0 0 11 26 1 1 0 0 0 M END > CFN99001 > Gelsemine > 509-15-9 > 98% > C20H22N2O2 > 322.4 > Powder > Alkaloids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Gelsemine-CFN99001.html $$$$