-ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 10 30 1 6 0 0 0 4 31 1 6 0 0 0 23 32 1 0 0 0 0 23 33 2 0 0 0 0 28 34 1 6 0 0 0 28 35 1 1 0 0 0 2 19 1 6 0 0 0 18 36 1 1 0 0 0 M END > CFN92068 > 3-Epioleanolic acid > 25499-90-5 > 98% > C30H48O3 > 456.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-Epioleanolic-acid-CFN92068.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 10 30 1 6 0 0 0 4 31 1 6 0 0 0 23 32 1 0 0 0 0 23 33 2 0 0 0 0 28 34 1 6 0 0 0 28 35 1 1 0 0 0 2 19 1 1 0 0 0 18 36 1 1 0 0 0 M END > CFN98800 > Oleanolic acid > 508-02-1 > 98% > C30H48O3 > 456.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Oleanolic-acid-CFN98800.html $$$$ -ISIS- 10201511232D 39 43 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0458 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -7.8792 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 28 34 1 6 0 0 0 28 35 1 1 0 0 0 2 19 1 1 0 0 0 18 36 1 1 0 0 0 19 37 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 M END > CFN98668 > 3-O-Acetyloleanolic acid > 4339-72-4 > 98% > C32H50O4 > 498.8 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-O-Acetyloleanolic-acid-CFN98668.html $$$$ -ISIS- 10201511232D 47 52 0 0 0 0 0 0 0 0999 V2000 3.4208 -4.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4208 -5.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1708 -5.8458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9208 -5.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9208 -4.5458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1708 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 -5.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 -4.5458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6750 -4.1125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1750 -4.1125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1750 -3.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 -2.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -3.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9250 -4.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6792 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6792 -3.2458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9250 -2.8125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6750 -5.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7333 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9208 -3.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 -3.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -3.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1750 -4.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6042 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -2.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -1.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6792 -1.5125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9250 -1.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2458 -0.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1125 -0.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9208 -6.2792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1750 -2.3792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -4.9792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1708 -3.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4208 -4.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9292 -5.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1833 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9292 -4.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4292 -5.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3167 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0625 -5.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8167 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8167 -6.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0625 -7.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3167 -6.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5625 -7.1417 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 2 19 1 1 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 18 33 1 1 0 0 0 10 34 1 6 0 0 0 23 35 1 0 0 0 0 23 36 2 0 0 0 0 19 37 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 40 2 0 0 0 0 40 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 44 47 1 0 0 0 0 M END > CFN96043 > 3-O-p-Coumaroyloleanolic acid > 151334-06-4 > 98% > C39H54O5 > 602.9 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-O-p-Coumaroyloleanolic-acid-CFN96043.html $$$$ -ISIS- 10201511232D 48 53 0 0 0 0 0 0 0 0999 V2000 3.4208 -4.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4208 -5.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1708 -5.8458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9208 -5.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9208 -4.5458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1708 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 -5.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 -4.5458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6750 -4.1125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1750 -4.1125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1750 -3.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 -2.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -3.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9250 -4.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6792 -4.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6792 -3.2458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9250 -2.8125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6750 -5.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7333 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9208 -3.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 -3.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -3.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1750 -4.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6042 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -2.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 -1.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6792 -1.5125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9250 -1.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2458 -0.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1125 -0.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9208 -6.2792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1750 -2.3792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -4.9792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1708 -3.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4208 -4.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9292 -5.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1833 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9292 -4.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4292 -5.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3167 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0625 -5.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8167 -5.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8167 -6.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0625 -7.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3167 -6.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5625 -7.1417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5667 -5.4125 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 2 19 1 1 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 18 33 1 1 0 0 0 10 34 1 6 0 0 0 23 35 1 0 0 0 0 23 36 2 0 0 0 0 19 37 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 40 2 0 0 0 0 40 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 44 47 1 0 0 0 0 43 48 1 0 0 0 0 M END > CFN96050 > 3-O-Caffeoyloleanolic acid > 97534-10-6 > 98% > C39H54O6 > 618.9 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-O-Caffeoyloleanolic-acid-CFN96050.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 10 30 1 6 0 0 0 4 31 1 6 0 0 0 23 32 1 0 0 0 0 23 33 2 0 0 0 0 28 34 1 6 0 0 0 28 35 1 1 0 0 0 2 19 2 0 0 0 0 18 36 1 1 0 0 0 M END > CFN92194 > 3-oxo-Olean-12-en-28-oic acid > 17990-42-0 > 98% > C30H46O3 > 454.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-oxo-Olean-12-en-28-oic-acid-CFN92194.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -8.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 10 30 1 6 0 0 0 4 31 1 6 0 0 0 23 32 1 0 0 0 0 23 33 2 0 0 0 0 28 34 1 6 0 0 0 28 35 1 1 0 0 0 2 19 1 1 0 0 0 18 36 1 1 0 0 0 16 37 1 6 0 0 0 M END > CFN98812 > Echinocystic acid > 510-30-5 > 98% > C30H48O4 > 472.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Echinocystic-acid-CFN98812.html $$$$ -ISIS- 10201511232D 35 39 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -3.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 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 6 0 0 0 18 34 1 1 0 0 0 28 35 2 0 0 0 0 M END > CFN99067 > 3alpha-Akebonoic acid > 104777-61-9 > 98% > C29H44O3 > 440.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3alpha-Akebonoic-acid-CFN99067.html $$$$ -ISIS- 10201511232D 86 95 0 0 0 0 0 0 0 0999 V2000 0.3208 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3208 -7.7708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9792 -8.1500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6375 -7.7708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6375 -7.0167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9792 -6.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2875 -8.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -7.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -7.0167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2875 -6.6375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6000 -6.6375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6000 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2875 -5.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -6.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -5.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2500 -5.5083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3375 -8.1500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 -6.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -6.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5667 -6.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -7.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3583 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5667 -5.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5667 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -4.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2875 -7.3958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 -8.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2167 -5.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5667 -7.0167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5958 -5.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9083 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9917 -7.7708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9917 -7.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -6.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3083 -7.0125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3083 -7.7708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6500 -8.1500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8750 -6.2667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8958 -7.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5625 -7.3875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2083 -7.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2083 -6.2667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5625 -5.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8625 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5667 -8.1417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9625 -6.6333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9625 -8.1500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -8.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 -7.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8625 -7.4083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3083 -9.2875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9667 -8.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6208 -9.2875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6208 -10.0458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9667 -10.4250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3083 -10.0458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2792 -10.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2792 -8.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9667 -11.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6542 -10.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5167 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1750 -5.8833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8333 -6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4917 -5.8833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4917 -5.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8333 -4.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1750 -5.1250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.1458 -6.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8333 -3.9875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5208 -4.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1458 -4.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8042 -4.3667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.4583 -4.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1167 -4.3667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.1167 -3.6083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4583 -3.2292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.8042 -3.6083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8042 -5.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1458 -3.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4583 -2.4708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7708 -4.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7750 -3.2292 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 6 0 0 0 18 34 1 1 0 0 0 28 35 2 0 0 0 0 36 19 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 42 32 1 6 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 6 0 0 0 44 49 1 6 0 0 0 39 50 1 1 0 0 0 40 51 1 1 0 0 0 41 52 1 6 0 0 0 43 53 1 1 0 0 0 45 54 1 1 0 0 0 55 52 1 1 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 55 1 0 0 0 0 58 61 1 1 0 0 0 57 62 1 6 0 0 0 59 63 1 6 0 0 0 60 64 1 6 0 0 0 48 65 1 0 0 0 0 66 65 1 1 0 0 0 66 67 1 0 0 0 0 67 68 1 0 0 0 0 68 69 1 0 0 0 0 69 70 1 0 0 0 0 70 71 1 0 0 0 0 71 66 1 0 0 0 0 68 72 1 1 0 0 0 70 73 1 1 0 0 0 71 74 1 6 0 0 0 69 75 1 6 0 0 0 76 75 1 1 0 0 0 76 77 1 0 0 0 0 77 78 1 0 0 0 0 78 79 1 0 0 0 0 79 80 1 0 0 0 0 80 81 1 0 0 0 0 81 76 1 0 0 0 0 72 82 1 0 0 0 0 81 83 1 6 0 0 0 80 84 1 6 0 0 0 78 85 1 6 0 0 0 79 86 1 1 0 0 0 M END > CFN99983 > Ciwujianoside B > 114902-16-8 > 98% > C58H92O25 > 1189.35 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Ciwujianoside-B-CFN99983.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 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 2 0 0 0 0 10 30 1 6 0 0 0 4 31 1 6 0 0 0 23 32 1 0 0 0 0 23 33 2 0 0 0 0 28 34 1 6 0 0 0 28 35 1 1 0 0 0 2 19 2 0 0 0 0 12 36 1 1 0 0 0 M END > CFN97145 > Moronic acid > 6713-27-5 > 98% > C30H46O3 > 454.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Moronic-acid-CFN97145.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5208 -6.9542 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 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 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 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 18 1 0 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 23 31 1 0 0 0 0 23 32 2 0 0 0 0 27 33 1 6 0 0 0 27 34 1 1 0 0 0 2 19 1 1 0 0 0 18 35 1 1 0 0 0 31 36 1 0 0 0 0 M END > CFN99079 > Pyrocincholic acid methyl ester > 107160-24-7 > 98% > C30H48O3 > 456.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Pyrocincholic-acid-methyl-ester-CFN99079.html $$$$ -ISIS- 10201511232D 44 49 0 0 0 0 0 0 0 0999 V2000 3.0292 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0292 -8.8583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8208 -9.3125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6167 -8.8583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6167 -7.9417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8208 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -9.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1958 -8.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1958 -7.9417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4000 -7.4875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9875 -7.4875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9875 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1958 -6.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -6.5750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7750 -6.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2375 -9.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 -10.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6167 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1958 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -8.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2792 -10.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3583 -5.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -4.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7750 -5.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1083 -3.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0208 -3.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6167 -9.7708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -8.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8167 -8.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2708 -6.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7292 -5.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6333 -5.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2708 -4.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0917 -4.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0917 -6.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6333 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -7.0292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -7.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1458 -6.5750 0.0000 O 0 0 0 0 0 0 0 0 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 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 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 18 1 0 0 0 0 2 19 1 0 0 0 0 27 29 1 1 0 0 0 27 30 1 6 0 0 0 4 31 1 6 0 0 0 10 32 1 6 0 0 0 2 33 1 1 0 0 0 21 33 1 0 0 0 0 25 34 1 1 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 38 2 0 0 0 0 36 39 1 0 0 0 0 38 40 1 0 0 0 0 17 42 1 1 0 0 0 18 41 1 1 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 42 43 2 0 0 0 0 42 44 1 0 0 0 0 G 42 17 COOH M STY 1 1 SUP M SLB 1 1 1 M SAL 1 3 42 43 44 M SBL 1 1 44 M SMT 1 COOH M SBV 1 44 -0.7900 0.4500 M END > CFN99606 > Camaric acid > 146450-83-1 > 98% > C35H52O6 > 568.8 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Camaric-acid-CFN99606.html $$$$ -ISIS- 10201511232D 43 47 0 0 0 0 0 0 0 0999 V2000 3.0292 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0292 -8.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8208 -9.3125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6167 -8.8583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6167 -7.9417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8208 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -9.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1958 -8.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1958 -7.9417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4000 -7.4875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9875 -7.4875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9875 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1958 -6.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -6.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -7.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -7.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -6.5750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7750 -6.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2375 -9.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 -10.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6167 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1958 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9875 -8.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2792 -10.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3583 -5.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5667 -4.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7750 -5.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1083 -3.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0208 -3.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6167 -9.7708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -8.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2708 -6.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7292 -5.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6333 -5.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2708 -4.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0917 -4.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0917 -6.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6333 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -7.0292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -7.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -7.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1458 -6.5750 0.0000 O 0 0 0 0 0 0 0 0 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 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 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 18 1 0 0 0 0 2 19 2 0 0 0 0 27 29 1 1 0 0 0 27 30 1 6 0 0 0 4 31 1 6 0 0 0 10 32 1 6 0 0 0 25 33 1 1 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 37 2 0 0 0 0 35 38 1 0 0 0 0 37 39 1 0 0 0 0 17 41 1 1 0 0 0 18 40 1 1 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 G 41 17 COOH M STY 1 1 SUP M SLB 1 1 1 M SAL 1 3 41 42 43 M SBL 1 1 42 M SMT 1 COOH M SBV 1 42 -0.7900 0.4500 M END > CFN97738 > Rehmannic acid > 467-81-2 > 98% > C35H52O5 > 552.80 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Rehmannic-acid-CFN97738.html $$$$ -ISIS- 10201511232D 37 43 0 0 0 0 0 0 0 0999 V2000 4.3583 -7.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3583 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -9.1125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9167 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9167 -7.7583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1375 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -9.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -7.7583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7000 -7.3083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2583 -7.3083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2583 -6.4083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4792 -5.9583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7000 -6.4083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0417 -7.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8208 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8208 -6.4083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0417 -5.9583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5792 -9.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6875 -9.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9167 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2583 -8.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5875 -9.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -5.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -5.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8208 -4.6042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0417 -5.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.2083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9167 -9.5625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3708 -3.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2708 -3.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0417 -6.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5042 -6.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2583 -5.5042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.5042 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 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 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 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 18 1 0 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 27 31 1 1 0 0 0 2 19 2 0 0 0 0 27 32 1 6 0 0 0 12 33 1 1 0 0 0 17 34 1 1 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 18 36 1 1 0 0 0 13 37 1 6 0 0 0 14 37 1 6 0 0 0 M END > CFN90155 > Liquidambaric lactone > 185051-75-6 > 98% > C30H44O4 > 468.67 > White powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Liquidambaric-lactone-CFN90155.html $$$$ -ISIS- 10201511232D 40 45 0 0 0 0 0 0 0 0999 V2000 4.3583 -7.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3583 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1375 -9.1125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9167 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9167 -7.7583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1375 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -9.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -7.7583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7000 -7.3083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2583 -7.3083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2583 -6.4083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4792 -5.9583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7000 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0417 -7.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8208 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8208 -6.4083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0417 -5.9583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5792 -9.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6875 -9.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9167 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2583 -8.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5875 -9.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -5.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -5.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8208 -4.6042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0417 -5.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.2083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9167 -9.5625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3708 -3.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2708 -3.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7958 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0167 -9.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7958 -7.7583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4792 -5.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0417 -6.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -6.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5042 -6.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2583 -5.5042 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 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 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 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 18 1 0 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 27 31 1 1 0 0 0 2 19 1 1 0 0 0 27 32 1 6 0 0 0 19 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 13 36 1 6 0 0 0 12 37 1 1 0 0 0 17 38 1 1 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 18 40 1 1 0 0 0 M END > CFN97080 > 3-O-Acetyloleanderolide > 62498-83-3 > 98% > C32H50O5 > 514.8 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-O-Acetyloleanderolide-CFN97080.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 4.0958 -7.0833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0958 -6.4833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6167 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -7.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -6.4833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6167 -6.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6583 -6.1833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6583 -5.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -5.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6167 -5.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -6.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6958 -6.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6958 -5.5833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1750 -5.2833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0958 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2167 -5.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6583 -6.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2167 -5.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2167 -4.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6958 -4.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1750 -4.6833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3958 -3.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9958 -3.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6583 -4.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -6.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -6.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -7.2667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1042 -7.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6833 -7.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3708 -5.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7708 -5.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -5.8833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0958 -7.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6167 -6.7833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7333 -5.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2167 -6.4833 0.0000 O 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 2 1 0 0 0 0 5 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 6 1 0 0 0 0 7 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 8 1 0 0 0 0 2 15 1 1 0 0 0 5 16 1 1 0 0 0 13 17 1 1 0 0 0 7 18 1 6 0 0 0 13 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 14 1 0 0 0 0 21 23 1 1 0 0 0 21 24 1 6 0 0 0 22 25 1 6 0 0 0 2 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 1 1 0 0 0 0 28 29 1 1 0 0 0 28 30 1 6 0 0 0 26 31 1 0 0 0 0 31 32 1 0 0 0 0 14 33 1 1 0 0 0 1 34 1 6 0 0 0 6 35 1 6 0 0 0 17 36 1 0 0 0 0 17 37 2 0 0 0 0 M END > CFN99269 > Sculponeatic acid > 1169806-02-3 > 98% > C30H46O4 > 470.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Sculponeatic-acid-CFN99269.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -6.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8708 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 34 23 1 0 0 0 0 23 35 2 0 0 0 0 2 19 1 6 0 0 0 18 36 1 1 0 0 0 20 37 1 0 0 0 0 M END > CFN99045 > Scutellaric acid > 102919-76-6 > 98% > C30H48O4 > 472.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Scutellaric-acid-CFN99045.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -6.9167 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 6 0 0 0 18 37 1 1 0 0 0 M END > CFN99802 > Wilforol C > 168254-95-3 > 98% > C30H48O4 > 472.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Wilforol-C-CFN99802.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -6.9167 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 18 37 1 1 0 0 0 M END > CFN98695 > Hederagenin > 465-99-6 > 98% > C30H48O4 > 472.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Hederagenin-CFN98695.html $$$$ -ISIS- 10201511232D 48 53 0 0 0 0 0 0 0 0999 V2000 4.1167 -8.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1167 -9.2833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9167 -9.7458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7125 -9.2833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7125 -8.3625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9167 -7.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -9.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3083 -9.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3083 -8.3625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5083 -7.9000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1042 -7.9000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1042 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3083 -6.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -6.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9000 -8.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7042 -7.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7042 -6.9792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9000 -6.5208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3167 -9.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -10.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7125 -7.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3083 -7.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -7.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1042 -8.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3750 -10.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -6.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -5.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7042 -5.1375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9000 -5.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2375 -4.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1625 -4.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7125 -10.2042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -8.8208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2958 -6.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -8.3625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9000 -7.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9167 -11.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3750 -12.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9167 -12.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -12.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -12.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3458 -12.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5875 -11.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9333 -10.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0458 -10.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8083 -11.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4583 -12.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3958 -10.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 34 23 1 0 0 0 0 23 35 2 0 0 0 0 2 19 1 1 0 0 0 18 36 1 1 0 0 0 25 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 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 46 1 0 0 0 0 46 47 2 0 0 0 0 47 42 1 0 0 0 0 45 48 1 0 0 0 0 M END > CFN92845 > (Z)-23-Coumaroylhederagenin > 654678-61-2 > 98% > C39H54O6 > 618.4 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Olean-12-en-28-oic-acid-CFN92845.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -6.9167 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 2 0 0 0 0 18 37 1 1 0 0 0 M END > CFN98696 > Hederagonic acid > 466-01-3 > 98% > C30H46O4 > 470.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Hederagonic-acid-CFN98696.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -6.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8708 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -10.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 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 6 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 1 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 34 23 1 0 0 0 0 23 35 2 0 0 0 0 2 19 1 1 0 0 0 18 36 1 1 0 0 0 20 37 1 0 0 0 0 7 38 1 1 0 0 0 M END > CFN99636 > Uncargenin C > 152243-70-4 > 98% > C30H48O5 > 488.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Uncargenin-C-CFN99636.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 3.1750 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -6.7250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6958 -7.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2125 -6.7250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2125 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6958 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -7.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -6.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -6.1250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7333 -5.8250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7708 -5.8250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7708 -5.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -4.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -5.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 -6.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8125 -5.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8125 -5.2250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2917 -4.9250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -7.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3958 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2125 -5.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -5.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -5.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -6.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9958 -7.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -4.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -4.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8125 -4.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2917 -4.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5125 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1125 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5958 -7.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2125 -7.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -6.4250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -4.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -5.2250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -6.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -8.0625 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 2 19 1 6 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 18 35 1 1 0 0 0 36 23 1 0 0 0 0 23 37 2 0 0 0 0 25 38 2 0 0 0 0 M END > CFN98227 > 3-Hydroxy-12-oleanene-23,28-dioic acid > 226562-47-6 > 98% > C30H46O5 > 486.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-Hydroxy-12-oleanene-23-28-dioic-acid-CFN98227.html $$$$ -ISIS- 10201511232D 49 54 0 0 0 0 0 0 0 0999 V2000 3.9667 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9667 -8.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7333 -8.7250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -8.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.3917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7333 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -8.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -7.3917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2750 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8125 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8125 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -5.6125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1958 -8.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2875 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8125 -7.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -4.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9125 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8000 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -7.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8875 -6.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1167 -7.3917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5792 -8.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5792 -9.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -9.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8125 -9.6083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1083 -9.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -9.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -10.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6458 -10.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4208 -10.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4208 -9.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6458 -9.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1833 -10.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1833 -9.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -6.5000 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 2 19 1 1 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 23 34 1 0 0 0 0 23 35 2 0 0 0 0 24 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 40 2 0 0 0 0 40 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 44 47 1 0 0 0 0 45 48 1 0 0 0 0 18 49 1 1 0 0 0 M END > CFN98931 > Myriceric acid B > 55497-79-5 > 98% > C39H54O7 > 634.9 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Myriceric-acid-B-CFN98931.html $$$$ -ISIS- 10201511232D 61 67 0 0 0 0 0 0 0 0999 V2000 3.9667 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9667 -8.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7333 -8.7250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -8.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.3917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7333 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -8.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -7.3917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2750 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8125 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8125 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -5.6125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1958 -8.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2875 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8125 -7.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -4.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9125 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8000 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -7.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8875 -6.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1167 -7.3917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5792 -8.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5792 -9.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 -9.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8125 -9.6083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1083 -9.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -9.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -10.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6458 -10.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4208 -10.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4208 -9.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6458 -9.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1833 -10.9417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1833 -9.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6583 -8.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -4.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8833 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8833 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -3.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1917 -4.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -6.5000 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 2 19 1 1 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 23 34 1 0 0 0 0 23 35 2 0 0 0 0 24 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 40 2 0 0 0 0 40 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 44 47 1 0 0 0 0 45 48 1 0 0 0 0 19 49 1 0 0 0 0 49 50 2 0 0 0 0 49 51 1 0 0 0 0 52 51 2 0 0 0 0 53 52 1 0 0 0 0 53 54 2 0 0 0 0 54 55 1 0 0 0 0 55 56 2 0 0 0 0 56 57 1 0 0 0 0 57 58 2 0 0 0 0 58 53 1 0 0 0 0 56 59 1 0 0 0 0 55 60 1 0 0 0 0 18 61 1 1 0 0 0 M END > CFN99683 > Myriceric acid C > 162059-94-1 > 98% > C48H60O10 > 797.0 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Myriceric-acid-C-CFN99683.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 10 30 1 6 0 0 0 4 31 1 6 0 0 0 23 32 1 0 0 0 0 23 33 2 0 0 0 0 28 34 1 6 0 0 0 28 35 1 1 0 0 0 1 36 1 6 0 0 0 2 19 1 1 0 0 0 18 37 1 1 0 0 0 M END > CFN98669 > Crategolic acid > 4373-41-5 > 98% > C30H48O4 > 472.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Crategolic-acid-CFN98669.html $$$$ -ISIS- 10201511232D 48 53 0 0 0 0 0 0 0 0999 V2000 3.9667 -7.3917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9667 -8.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7333 -8.7250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -8.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.3917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7333 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -8.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -7.3917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2750 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8125 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8125 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -5.6125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1958 -8.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2875 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8125 -7.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -4.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9125 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8000 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -7.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8875 -6.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1167 -7.3917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6583 -8.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -4.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8833 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8833 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -3.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -6.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1958 -6.9458 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 2 19 1 1 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 23 34 1 0 0 0 0 23 35 2 0 0 0 0 19 36 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 39 38 2 0 0 0 0 40 39 1 0 0 0 0 40 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 40 1 0 0 0 0 43 46 1 0 0 0 0 18 47 1 1 0 0 0 1 48 1 6 0 0 0 M END > CFN92210 > 3-beta-O-(trans-p-Coumaroyl)maslinic acid > 35482-91-8 > 98% > C39H54O6 > 618.9 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-beta-O-trans-p-Coumaroyl-maslinic-acid-CFN92210.html $$$$ -ISIS- 10201511232D 48 53 0 0 0 0 0 0 0 0999 V2000 3.9667 -7.3917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9667 -8.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7333 -8.7250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -8.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.3917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7333 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -8.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -7.3917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2750 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8125 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8125 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -5.6125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1958 -8.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2875 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8125 -7.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -4.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9125 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8000 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -7.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8875 -6.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1167 -7.3917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6583 -8.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -6.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1958 -6.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8833 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1125 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6583 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6583 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1125 -8.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8833 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -8.7208 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 2 19 1 1 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 23 34 1 0 0 0 0 23 35 2 0 0 0 0 19 36 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 39 38 2 0 0 0 0 18 40 1 1 0 0 0 1 41 1 6 0 0 0 39 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 46 1 0 0 0 0 46 47 2 0 0 0 0 47 42 1 0 0 0 0 45 48 1 0 0 0 0 M END > CFN92208 > 3-beta-O-(cis-p-Coumaroyl)maslinic acid > 69297-40-1 > 98% > C39H54O6 > 618.9 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-beta-O-cis-p-Coumaroyl-maslinic-acid-CFN92208.html $$$$ -ISIS- 10201511232D 50 55 0 0 0 0 0 0 0 0999 V2000 3.9667 -7.3917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9667 -8.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7333 -8.7250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -8.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.3917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7333 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -8.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -7.3917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2750 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8125 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8125 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -6.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -5.6125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1958 -8.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2875 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0458 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8125 -7.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 -9.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1208 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3583 -4.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5833 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9125 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8000 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -7.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8875 -6.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1167 -7.3917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6583 -8.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -7.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -6.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -4.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8833 -4.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8833 -5.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -3.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1917 -4.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 -6.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1958 -6.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1917 -3.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 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 2 19 1 1 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 23 34 1 0 0 0 0 23 35 2 0 0 0 0 19 36 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 39 38 2 0 0 0 0 40 39 1 0 0 0 0 40 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 40 1 0 0 0 0 43 46 1 0 0 0 0 42 47 1 0 0 0 0 18 48 1 1 0 0 0 1 49 1 6 0 0 0 47 50 1 0 0 0 0 M END > CFN92275 > Eucalyptolic acid > 189272-68-2 > 98% > C40H56O7 > 648.9 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Eucalyptolic-acid-CFN92275.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 -0.2542 -3.5625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2542 -4.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5500 -4.9625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3625 -4.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3625 -3.5625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5500 -3.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -4.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9833 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9833 -3.5625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1750 -3.1042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7958 -3.1042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7958 -2.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9833 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -2.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6083 -3.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4125 -3.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4125 -2.1667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6083 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -0.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4125 -0.2958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6083 -0.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0833 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0208 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0667 -3.1042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0667 -4.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3625 -2.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9833 -2.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7958 -4.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -2.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -3.5625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0292 -2.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 0.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 0.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3625 -5.4292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -4.0333 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 2 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 2 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 3 23 1 1 0 0 0 3 24 1 6 0 0 0 1 25 1 6 0 0 0 2 26 1 1 0 0 0 5 27 1 1 0 0 0 9 28 1 1 0 0 0 11 29 1 6 0 0 0 17 30 1 1 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 21 33 1 6 0 0 0 21 34 1 1 0 0 0 4 35 1 6 0 0 0 10 36 1 6 0 0 0 M END > CFN96017 > Camaldulenic acid > 71850-15-2 > 98% > C30H46O4 > 470.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Camaldulenic-acid-CFN96017.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4875 -4.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 10 30 1 6 0 0 0 4 31 1 6 0 0 0 23 32 1 0 0 0 0 23 33 2 0 0 0 0 28 34 1 6 0 0 0 28 35 1 1 0 0 0 1 36 1 6 0 0 0 2 19 1 1 0 0 0 29 37 1 6 0 0 0 18 38 1 1 0 0 0 M END > CFN98397 > Arjunic acid > 31298-06-3 > 98% > C30H48O5 > 488.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Arjunic-acid-CFN98397.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -5.5167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 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 1 30 1 6 0 0 0 28 31 1 1 0 0 0 28 32 1 6 0 0 0 25 33 1 0 0 0 0 4 34 1 6 0 0 0 10 35 1 6 0 0 0 18 36 1 1 0 0 0 37 23 1 0 0 0 0 23 38 2 0 0 0 0 2 19 1 1 0 0 0 M END > CFN98690 > Arjunolic acid > 465-00-9 > 98% > C30H48O5 > 488.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Arjunolic-acid-CFN98690.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4625 -8.8083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -9.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -8.8083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0792 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2708 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -9.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -7.8792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8792 -7.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4958 -7.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4958 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -7.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -7.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -6.4917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2958 -6.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6875 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 -8.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 -10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -6.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -4.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2958 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -8.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 -9.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 -7.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6417 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 10 30 1 6 0 0 0 4 31 1 6 0 0 0 23 32 1 0 0 0 0 23 33 2 0 0 0 0 28 34 1 6 0 0 0 28 35 1 1 0 0 0 1 36 1 6 0 0 0 2 19 1 6 0 0 0 18 37 1 1 0 0 0 M END > CFN98310 > 2,3-Dihydroxy-12-oleanen-28-oic acid > 26563-68-8 > 98% > C30H48O4 > 472.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-3-Dihydroxy-12-oleanen-28-oic-acid-CFN98310.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -6.9167 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 1 30 1 6 0 0 0 28 31 1 1 0 0 0 28 32 1 6 0 0 0 25 33 1 0 0 0 0 4 34 1 6 0 0 0 10 35 1 6 0 0 0 36 23 1 0 0 0 0 23 37 2 0 0 0 0 2 19 1 6 0 0 0 18 38 1 1 0 0 0 M END > CFN99041 > 2,3,23-Trihydroxy-12-oleanen-28-oic acid > 102519-34-6 > 98% > C30H48O5 > 488.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-3-23-Trihydroxy-12-oleanen-28-oic-acid-CFN99041.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -6.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8708 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 17 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 18 1 0 0 0 0 28 30 1 1 0 0 0 28 31 1 6 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 34 23 1 0 0 0 0 23 35 2 0 0 0 0 2 19 1 6 0 0 0 18 36 1 1 0 0 0 20 37 1 0 0 0 0 1 38 1 6 0 0 0 M END > CFN99628 > 2,3,24-Trihydroxyolean-12-en-28-oic acid > 150821-16-2 > 98% > C30H48O5 > 488.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-3-24-Trihydroxyolean-12-en-28-oic-acid-CFN99628.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -6.9167 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 1 30 1 1 0 0 0 28 31 1 1 0 0 0 28 32 1 6 0 0 0 25 33 1 0 0 0 0 4 34 1 6 0 0 0 10 35 1 6 0 0 0 36 23 1 0 0 0 0 23 37 2 0 0 0 0 2 19 1 1 0 0 0 18 38 1 1 0 0 0 M END > CFN90314 > Bayogenin > 6989-24-8 > 98% > C30H48O5 > 488.70 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Bayogenin-CFN90314.html $$$$ -ISIS- 10201511232D 39 43 0 0 0 0 0 0 0 0999 V2000 -0.5083 -4.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5083 -5.1208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3042 -5.5917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1125 -5.1208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1125 -4.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3042 -3.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -5.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7292 -5.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7292 -4.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9208 -3.7208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5375 -3.7208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5375 -2.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7292 -2.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -2.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -4.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -3.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -2.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3500 -2.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3167 -5.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1667 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -3.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7292 -3.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -3.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7667 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -2.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -1.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -0.9167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3500 -1.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6875 -0.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6208 -0.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7042 -6.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -6.0542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -4.6583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7750 -2.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -4.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -3.7208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -3.2542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5375 -4.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5833 -3.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 18 1 0 0 0 0 2 19 1 1 0 0 0 27 29 1 1 0 0 0 27 30 1 6 0 0 0 24 31 1 0 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 34 23 1 0 0 0 0 23 35 2 0 0 0 0 1 36 1 1 0 0 0 18 37 1 1 0 0 0 11 38 1 6 0 0 0 34 39 1 0 0 0 0 M END > CFN92819 > Bayogenin methyl ester > 22425-81-6 > 98% > C31H50O5 > 502.4 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Bayogenin-methyl-ester-CFN92819.html $$$$ -ISIS- 10201511232D 39 43 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -6.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -8.3167 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 1 30 1 1 0 0 0 28 31 1 1 0 0 0 28 32 1 6 0 0 0 25 33 1 0 0 0 0 4 34 1 6 0 0 0 10 35 1 6 0 0 0 36 23 1 0 0 0 0 23 37 2 0 0 0 0 2 19 1 1 0 0 0 18 38 1 1 0 0 0 16 39 1 6 0 0 0 M END > CFN99108 > Polygalacic acid > 22338-71-2 > 98% > C30H48O6 > 504.71 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Polygalacic-acid-CFN99108.html $$$$ -ISIS- 10201511232D 40 44 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -6.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -8.3167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8708 -10.0625 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 1 30 1 1 0 0 0 28 31 1 1 0 0 0 28 32 1 6 0 0 0 25 33 1 0 0 0 0 4 34 1 6 0 0 0 10 35 1 6 0 0 0 36 23 1 0 0 0 0 23 37 2 0 0 0 0 2 19 1 1 0 0 0 18 38 1 1 0 0 0 16 39 1 6 0 0 0 20 40 1 0 0 0 0 M END > CFN92207 > Platycodigenin > 22327-82-8 > 98% > C30H48O7 > 520.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Platycodigenin-CFN92207.html $$$$ -ISIS- 10201511232D 41 45 0 0 0 0 0 0 0 0999 V2000 3.4625 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4625 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2750 -9.2542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -8.7833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0833 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -9.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -8.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -7.8500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8917 -7.3833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5083 -7.3833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5083 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -6.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -7.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -6.4500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -9.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8042 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5083 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 -10.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -4.5792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6583 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 -9.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -8.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7458 -6.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9375 -7.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -6.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1250 -2.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 -3.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2583 -4.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 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 1 30 1 1 0 0 0 28 31 1 1 0 0 0 28 32 1 6 0 0 0 25 33 1 0 0 0 0 4 34 1 6 0 0 0 10 35 1 6 0 0 0 36 23 1 0 0 0 0 23 37 2 0 0 0 0 2 19 1 1 0 0 0 18 38 1 1 0 0 0 31 39 2 0 0 0 0 31 40 1 0 0 0 0 40 41 1 0 0 0 0 M END > CFN99844 > Phytolaccagenin > 1802-12-6 > 98% > C31H48O7 > 532.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Phytolaccagenin-CFN99844.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 3.4375 -7.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4375 -8.3625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2250 -8.8167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0083 -8.3625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0083 -7.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2250 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7917 -8.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 -8.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 -7.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7917 -7.0042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3583 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3583 -6.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7917 -6.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1458 -7.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9292 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9292 -6.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1458 -5.6458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6542 -8.8167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7708 -9.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0083 -6.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 -6.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7125 -6.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -9.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7125 -5.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7125 -4.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9292 -4.2875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1458 -4.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4750 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3792 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5833 -9.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0083 -9.2667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7917 -7.9125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3583 -5.1958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4958 -6.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7125 -7.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -10.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -7.0042 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 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 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 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 18 1 0 0 0 0 2 19 1 1 0 0 0 27 29 1 1 0 0 0 27 30 1 6 0 0 0 24 31 1 0 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 18 34 1 1 0 0 0 35 23 1 0 0 0 0 23 36 2 0 0 0 0 24 37 2 0 0 0 0 1 38 1 1 0 0 0 M END > CFN92195 > Polygalic acid > 1260-04-4 > 98% > C29H44O6 > 488.7 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Polygalic-acid-CFN92195.html $$$$ -ISIS- 10201511232D 40 44 0 0 0 0 0 0 0 0999 V2000 -0.5083 -4.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5083 -5.1208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3042 -5.5917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1125 -5.1208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1125 -4.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3042 -3.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -5.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7292 -5.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7292 -4.1875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9208 -3.7208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5375 -3.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5375 -2.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7292 -2.3167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9208 -2.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -4.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -3.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -2.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3500 -2.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3167 -5.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1667 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -3.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7292 -3.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -3.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7667 -6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -2.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -1.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -0.9167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3500 -1.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6875 -0.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6208 -0.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7042 -6.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -6.0542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -4.6583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5375 -1.8542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7750 -2.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -4.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3042 -7.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -3.7208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7292 -1.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -0.9208 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 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 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 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 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 18 1 0 0 0 0 2 19 1 1 0 0 0 27 29 1 1 0 0 0 27 30 1 6 0 0 0 24 31 1 0 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 18 34 1 1 0 0 0 35 23 1 0 0 0 0 23 36 2 0 0 0 0 24 37 2 0 0 0 0 1 38 1 1 0 0 0 13 39 1 6 0 0 0 39 40 1 0 0 0 0 M END > CFN99109 > Senegenin > 2469-34-3 > 98% > C30H45ClO6 > 537.14 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Senegenin-CFN99109.html $$$$