-ISIS- 10201511232D 35 39 0 0 0 0 0 0 0 0999 V2000 3.9250 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7083 -8.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5042 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8750 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8750 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0792 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -6.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2458 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -4.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2458 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -4.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -3.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -7.8625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -8.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2542 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -5.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -6.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 1 1 0 0 0 3 32 1 6 0 0 0 3 33 1 1 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 M END > CFN98913 > Lupeol > 545-47-1 > 98% > C30H50O > 426.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Lupeol-CFN98913.html $$$$ -ISIS- 10201511232D 47 52 0 0 0 0 0 0 0 0999 V2000 6.5708 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 -8.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2875 -8.4750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0000 -8.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0000 -7.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2875 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -7.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7167 -6.8208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1500 -6.8208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1500 -5.9917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4333 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -5.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5833 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5833 -5.9917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8542 -8.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -9.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3000 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -7.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 -9.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -4.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3000 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3000 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -4.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -8.8875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -7.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -5.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -6.4083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4208 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9875 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -7.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2708 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5542 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5542 -9.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2708 -9.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9875 -9.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8375 -9.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8375 -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 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 2 19 1 1 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 18 26 1 0 0 0 0 17 27 1 0 0 0 0 27 28 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 6 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 36 19 1 0 0 0 0 37 36 1 0 0 0 0 37 38 2 0 0 0 0 38 39 1 0 0 0 0 36 40 2 0 0 0 0 39 41 2 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 43 44 1 0 0 0 0 44 45 2 0 0 0 0 45 39 1 0 0 0 0 43 46 1 0 0 0 0 42 47 1 0 0 0 0 M END > CFN99057 > Lupeol caffeate > 103917-26-6 > 98% > C39H56O4 > 588.9 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Lupeol-caffeate-CFN99057.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.9250 -7.4042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9250 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7083 -8.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5042 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8750 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8750 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0792 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -6.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2458 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -4.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2458 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -4.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -3.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -7.8625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -8.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2542 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -5.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -6.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -6.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 1 1 0 0 0 3 32 1 6 0 0 0 3 33 1 1 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 1 36 1 6 0 0 0 M END > CFN97717 > Lup-20(29)-ene-2alpha,3beta-diol > 61448-03-1 > 98% > C30H50O2 > 442.73 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Lup-20-29-ene-2-3-diol-CFN97717.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.9167 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9167 -8.7542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -9.2167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5083 -8.7542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5083 -7.8375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -7.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3042 -9.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -8.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -7.8375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3042 -7.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8958 -7.3750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8958 -6.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0958 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3042 -6.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4833 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4833 -6.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6917 -6.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2833 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -5.0792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2833 -5.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -5.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -3.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -8.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3042 -8.2958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -9.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1208 -9.2167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -10.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -10.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -5.5375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -6.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 -6.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 1 6 0 0 0 3 32 1 6 0 0 0 3 33 1 1 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 6 36 1 1 0 0 0 M END > CFN97128 > Glochidiol > 6610-56-6 > 98% > C30H50O2 > 442.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Glochidiol-CFN97128.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.9250 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7083 -8.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5042 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8750 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8750 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0792 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -6.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2458 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -4.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2458 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -4.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -3.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -7.8625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -8.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2542 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -5.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -6.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 -6.0333 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 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 1 1 0 0 0 3 32 1 6 0 0 0 3 33 1 1 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 6 36 1 1 0 0 0 M END > CFN98360 > 3-Epiglochidiol > 29028-10-2 > 98% > C30H50O2 > 442.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-Epiglochidiol-CFN98360.html $$$$ -ISIS- 10201511232D 42 46 0 0 0 0 0 0 0 0999 V2000 3.9250 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7083 -8.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5042 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8750 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8750 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0792 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -6.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2458 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -4.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2458 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -4.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -3.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -7.8625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -8.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2542 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -5.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -6.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 -6.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9208 -4.6667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -6.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3417 -8.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -8.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3375 -7.4083 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 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 1 1 0 0 0 3 32 1 6 0 0 0 3 33 1 1 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 6 36 1 1 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 31 40 1 0 0 0 0 40 41 1 0 0 0 0 40 42 2 0 0 0 0 M END > CFN97122 > 3-Epiglochidiol diacetate > 6587-37-7 > 98% > C34H54O4 > 526.8 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-Epiglochidiol-diacetate-CFN97122.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.9167 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9167 -8.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 -9.2167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5083 -8.7542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5083 -7.8375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -7.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3042 -9.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -8.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -7.8375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3042 -7.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8958 -7.3750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8958 -6.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0958 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3042 -6.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4833 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4833 -6.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6917 -6.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2833 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -5.0792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2833 -5.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -5.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -3.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -8.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3042 -8.2958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -9.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1208 -9.2167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -10.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -10.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -5.5375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -6.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 -6.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 2 0 0 0 0 3 32 1 6 0 0 0 3 33 1 1 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 6 36 1 1 0 0 0 M END > CFN98248 > Glochidonol > 23963-54-4 > 98% > C30H48O2 > 440.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Glochidonol-CFN98248.html $$$$ -ISIS- 10201511232D 35 39 0 0 0 0 0 0 0 0999 V2000 3.9250 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 -8.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5042 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8750 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8750 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0792 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -6.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2458 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -4.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2458 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -4.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -3.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -7.8625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -8.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2542 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -5.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -6.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 2 0 0 0 0 3 32 1 6 0 0 0 3 33 1 1 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 M END > CFN97127 > Glochidone > 6610-55-5 > 98% > C30H46O > 422.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Glochidone-CFN97127.html $$$$ -ISIS- 10201511232D 35 39 0 0 0 0 0 0 0 0999 V2000 3.9250 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 -8.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5042 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8750 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8750 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0792 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -6.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2458 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -4.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2458 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -4.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -3.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -7.8625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -8.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2542 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -5.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -6.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 2 0 0 0 0 3 32 1 6 0 0 0 3 33 1 1 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 M END > CFN99681 > Lupenone > 1617-70-5 > 98% > C30H48O > 424.7 > White powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Lupenone-CFN99681.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.9250 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7083 -8.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5042 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8750 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8750 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0792 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -6.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2458 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -4.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2458 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -4.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -3.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -7.8625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -8.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2542 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -5.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -6.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2875 -4.2083 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 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 1 1 0 0 0 3 32 1 6 0 0 0 3 33 1 1 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 23 36 1 0 0 0 0 M END > CFN97791 > Hennadiol > 20065-99-0 > 98% > C30H50O2 > 442.73 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Hennadiol-CFN97791.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.9250 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 -8.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5042 -8.3167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5042 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -8.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -8.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -7.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2958 -6.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8750 -6.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8750 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0792 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -6.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -7.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 -6.0333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2458 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -4.6667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2458 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -4.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -4.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -3.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0792 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -7.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2958 -7.8625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -9.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -8.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2542 -9.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -5.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -6.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2875 -4.2083 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 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 2 0 0 0 0 3 32 1 6 0 0 0 3 33 1 1 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 23 36 1 0 0 0 0 M END > CFN97213 > 30-Hydroxylup-20(29)-en-3-one > 72944-06-0 > 98% > C30H48O2 > 440.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/30-Hydroxylup-20-29-en-3-one-CFN97213.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.9167 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9167 -8.7542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -9.2167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5083 -8.7542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5083 -7.8375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7083 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3042 -9.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -8.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -7.8375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3042 -7.3750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8958 -7.3750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8958 -6.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0958 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3042 -6.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4833 -7.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4833 -6.4583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6917 -6.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2833 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -5.0792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2833 -5.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -5.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -3.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2833 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -6.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -8.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3042 -8.2958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -9.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1208 -9.2167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1708 -10.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -10.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3292 -10.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8958 -5.5375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -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 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 6 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 17 25 1 1 0 0 0 9 26 1 1 0 0 0 5 27 1 1 0 0 0 11 28 1 6 0 0 0 10 29 1 6 0 0 0 4 30 1 6 0 0 0 2 31 1 6 0 0 0 3 32 1 1 0 0 0 3 33 1 6 0 0 0 33 34 1 0 0 0 0 12 35 1 1 0 0 0 18 36 1 6 0 0 0 M END > CFN98412 > 20(29)-Lupene-3,23-diol > 32451-85-7 > 98% > C30H50O2 > 442.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/20-29-Lupene-3-23-diol-CFN98412.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.4583 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4583 -8.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2667 -9.3417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0708 -8.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0708 -7.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2667 -7.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -9.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -8.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -7.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8750 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4875 -7.4792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4875 -6.5500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6792 -6.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -6.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2875 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0958 -7.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0958 -6.5500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2875 -6.0875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8000 -10.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0708 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9000 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4875 -8.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -10.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9000 -6.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9000 -5.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2875 -5.1583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0708 -9.8042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -8.4125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -4.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -5.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4875 -5.6208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2875 -7.0167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7042 -6.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 2 36 1 1 0 0 0 M END > CFN98710 > Betulin > 473-98-3 > 98% > C30H50O2 > 442.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Betulin-CFN98710.html $$$$ -ISIS- 10201511232D 47 52 0 0 0 0 0 0 0 0999 V2000 6.5708 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 -8.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2875 -8.4750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0000 -8.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0000 -7.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2875 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -7.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7167 -6.8208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1500 -6.8208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1500 -5.9917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4333 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -5.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5833 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5833 -5.9917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8542 -8.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -9.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3000 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -7.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 -9.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -4.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3000 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3000 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -4.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -8.8875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -7.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -5.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -6.4083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4208 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9875 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -7.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2708 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5542 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5542 -9.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2708 -9.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9875 -9.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8375 -9.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0167 -5.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 2 19 1 1 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 18 26 1 0 0 0 0 17 27 1 0 0 0 0 27 28 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 6 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 36 19 1 0 0 0 0 37 36 1 0 0 0 0 37 38 2 0 0 0 0 38 39 1 0 0 0 0 36 40 2 0 0 0 0 39 41 2 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 43 44 1 0 0 0 0 44 45 2 0 0 0 0 45 39 1 0 0 0 0 43 46 1 0 0 0 0 23 47 1 0 0 0 0 M END > CFN99486 > 3-O-(E)-p-Coumaroylbetulin > 144424-80-6 > 98% > C39H56O4 > 588.9 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-O-E-p-Coumaroylbetulin-CFN99486.html $$$$ -ISIS- 10201511232D 48 53 0 0 0 0 0 0 0 0999 V2000 6.5708 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 -8.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2875 -8.4750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0000 -8.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0000 -7.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2875 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -7.2333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7167 -6.8208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1500 -6.8208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1500 -5.9917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4333 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -5.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -7.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5833 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5833 -5.9917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8667 -5.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8542 -8.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -9.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3000 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -7.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 -9.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -4.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3000 -5.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3000 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -4.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -8.8875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7167 -7.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -5.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -6.4083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4208 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9875 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -7.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2708 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5542 -8.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5542 -9.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2708 -9.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9875 -9.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8375 -9.7167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8375 -8.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0167 -5.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 2 19 1 1 0 0 0 3 20 1 1 0 0 0 5 21 1 1 0 0 0 9 22 1 1 0 0 0 17 23 1 1 0 0 0 11 24 1 6 0 0 0 3 25 1 6 0 0 0 18 26 1 0 0 0 0 17 27 1 0 0 0 0 27 28 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 6 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 4 32 1 6 0 0 0 10 33 1 6 0 0 0 12 34 1 1 0 0 0 18 35 1 6 0 0 0 36 19 1 0 0 0 0 37 36 1 0 0 0 0 37 38 2 0 0 0 0 38 39 1 0 0 0 0 36 40 2 0 0 0 0 39 41 2 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 43 44 1 0 0 0 0 44 45 2 0 0 0 0 45 39 1 0 0 0 0 43 46 1 0 0 0 0 42 47 1 0 0 0 0 23 48 1 0 0 0 0 M END > CFN97459 > Betulin caffeate > 89130-86-9 > 98% > C39H56O5 > 604.9 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Betulin-caffeate-CFN97459.html $$$$ -ISIS- 10201511232D 53 57 0 0 0 0 0 0 0 0999 V2000 6.4167 -7.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4167 -8.3750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1458 -8.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8708 -8.3750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8708 -7.5375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1458 -7.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5958 -8.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3208 -8.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3208 -7.5375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5958 -7.1167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0500 -7.1167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0500 -6.2792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3208 -5.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5958 -6.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7708 -7.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5000 -7.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5000 -6.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7708 -5.8583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6875 -8.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -9.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8708 -6.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3208 -6.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2250 -6.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0500 -7.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5625 -9.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2250 -5.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2250 -5.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7708 -5.0208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8708 -9.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5958 -7.9542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9542 -6.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9625 -8.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2375 -8.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5125 -8.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7875 -8.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0583 -8.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3333 -8.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6083 -8.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6083 -7.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3333 -7.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3333 -6.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0583 -5.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7875 -6.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5125 -5.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2375 -6.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9625 -5.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -6.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9625 -7.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0458 -4.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3208 -5.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0458 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0500 -5.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7708 -6.6958 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 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 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 28 18 1 0 0 0 0 4 29 1 6 0 0 0 10 30 1 6 0 0 0 31 23 1 0 0 0 0 35 34 1 0 0 0 0 36 35 1 0 0 0 0 37 36 1 0 0 0 0 38 37 1 0 0 0 0 39 38 1 0 0 0 0 40 39 1 0 0 0 0 41 40 1 0 0 0 0 42 41 1 0 0 0 0 43 42 1 0 0 0 0 44 43 1 0 0 0 0 45 44 1 0 0 0 0 46 45 1 0 0 0 0 47 46 1 0 0 0 0 32 48 2 0 0 0 0 33 32 1 0 0 0 0 32 19 1 0 0 0 0 2 19 1 1 0 0 0 34 33 1 0 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 28 27 1 0 0 0 0 28 49 1 6 0 0 0 49 50 1 0 0 0 0 49 51 2 0 0 0 0 12 52 1 1 0 0 0 18 53 1 6 0 0 0 M END > CFN98986 > Betulin palmitate > 582315-55-7 > 98% > C46H80O3 > 681.1 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Betulin-palmitate-CFN98986.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4583 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4583 -8.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2667 -9.3417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0708 -8.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0708 -7.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2667 -7.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -9.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -8.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -7.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8750 -7.4792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4875 -7.4792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4875 -6.5500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6792 -6.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -6.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2875 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0958 -7.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0958 -6.5500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2875 -6.0875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8000 -10.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0708 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9000 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4875 -8.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7292 -10.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9000 -6.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9000 -5.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2875 -5.1583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0708 -9.8042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -8.4125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -4.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -5.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4875 -5.6208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2875 -7.0167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7042 -6.5500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9000 -7.9458 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 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 2 36 1 1 0 0 0 22 37 2 0 0 0 0 M END > CFN99759 > Betulinaldehyde > 13159-28-9 > 98% > C30H48O2 > 440.70 > White cryst. > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Betulinaldehyde-CFN99759.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4250 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1958 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -7.3208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2833 -7.3208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2833 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5083 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0500 -5.9875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7542 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -5.0958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -9.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -8.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -5.5417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -6.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 22 36 2 0 0 0 0 2 37 1 1 0 0 0 M END > CFN98706 > Betulinic acid > 472-15-1 > 98% > C30H48O3 > 456.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Betulinic-acid-CFN98706.html $$$$ -ISIS- 10201511232D 37 41 0 0 0 0 0 0 0 0999 V2000 3.4250 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -7.3208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2833 -7.3208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2833 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5083 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0500 -5.9875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7542 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -5.0958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -9.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -8.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -5.5417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -6.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 22 36 2 0 0 0 0 2 37 2 0 0 0 0 M END > CFN98682 > Betulonic acid > 4481-62-3 > 98% > C30H46O3 > 454.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Betulonic-acid-CFN98682.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 3.4250 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -7.3208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2833 -7.3208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2833 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5083 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0500 -5.9875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7542 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -5.0958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -9.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -8.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.6500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5083 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -5.5417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -6.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -4.2083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 22 36 2 0 0 0 0 2 37 2 0 0 0 0 30 38 1 0 0 0 0 M END > CFN97504 > 20-Hydroxy-3-oxo-28-lupanoic acid > 93372-87-3 > 98% > C30H48O4 > 472.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/20-Hydroxy-3-oxo-28-lupanoic-acid-CFN97504.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 3.4583 -7.9458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4583 -8.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2667 -9.3417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0750 -8.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0750 -7.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2667 -7.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -9.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6833 -8.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6833 -7.9458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8750 -7.4833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4917 -7.4833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4917 -6.5500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6833 -6.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -6.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2917 -7.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1000 -7.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1000 -6.5500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2917 -6.0875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8042 -10.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6833 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9042 -7.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -8.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -10.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9042 -6.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9042 -5.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2917 -5.1583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0750 -9.8083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -8.4125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -4.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 -5.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4833 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4917 -5.6208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2917 -7.0167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7125 -6.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9042 -7.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 22 36 2 0 0 0 0 2 37 1 1 0 0 0 1 38 1 6 0 0 0 M END > CFN99896 > Alphitolic acid > 19533-92-7 > 98% > C30H48O4 > 472.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Alphitolic-acid-CFN99896.html $$$$ -ISIS- 10201511232D 41 45 0 0 0 0 0 0 0 0999 V2000 3.4250 -7.7667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4250 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1958 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -7.3208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2833 -7.3208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2833 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5083 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0500 -5.9875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7542 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -5.0958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -9.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -8.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -5.5417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -6.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -7.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8833 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8833 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 22 36 2 0 0 0 0 2 37 1 1 0 0 0 1 38 1 6 0 0 0 37 39 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 M END > CFN92092 > 2alpha-hydroxy-3beta-acetyloxy-betulic acid > 1163728-89-9 > 98% > C32H50O5 > 514.8 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/2-hydroxy-3-acetyloxy-betulic-acid-CFN92092.html $$$$ -ISIS- 10201511232D 39 43 0 0 0 0 0 0 0 0999 V2000 3.4250 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -8.6583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -7.3208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2833 -7.3208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2833 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5083 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0500 -5.9875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7542 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -5.0958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -9.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -8.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -5.5417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -6.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -8.6583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1333 -6.8750 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 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 22 36 2 0 0 0 0 2 37 1 6 0 0 0 23 38 1 0 0 0 0 35 39 1 0 0 0 0 M END > CFN98305 > 3,27-Dihydroxy-20(29)-lupen-28-oic acid methyl ester > 263844-79-7 > 98% > C31H50O4 > 486.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-27-Dihydroxy-20-29-lupen-28-oic-acid-methyl-ester-CFN98305.html $$$$ -ISIS- 10201511232D 42 46 0 0 0 0 0 0 0 0999 V2000 3.4250 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -8.6583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -7.3208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2833 -7.3208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2833 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5083 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0500 -5.9875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7542 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -5.0958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -9.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -8.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -5.5417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -6.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8833 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8833 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -8.6583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1333 -6.8750 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 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 22 36 2 0 0 0 0 2 37 1 6 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 40 2 0 0 0 0 23 41 1 0 0 0 0 35 42 1 0 0 0 0 M END > CFN98306 > 3-Acetoxy-27-hydroxy-20(29)-lupen-28-oic acid methyl ester > 263844-80-0 > 98% > C33H52O5 > 528.8 > Cryst. > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/3-Acetoxy-27-hydroxy-20-29-lupen-28-oic-acid-methyl-ester--CFN98306.html $$$$ -ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 3.4250 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1958 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -7.3208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2833 -7.3208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2833 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5083 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0500 -5.9875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7542 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -5.0958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -9.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -8.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -5.5417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -6.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4125 -10.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 22 36 2 0 0 0 0 2 37 1 1 0 0 0 24 38 1 0 0 0 0 M END > CFN90310 > Anemosapogenin > 85999-40-2 > 98% > C30H48O4 > 472.71 > White cryst. > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Anemosapogenin-CFN90310.html $$$$ -ISIS- 10201511232D 57 63 0 0 0 0 0 0 0 0999 V2000 3.4250 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1958 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -7.3208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2833 -7.3208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2833 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5083 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0500 -5.9875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7542 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -5.0958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -9.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -8.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -5.5417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -6.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8833 -8.6583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8833 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3417 -7.7667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3417 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1125 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1125 -9.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4292 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4292 -7.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3417 -10.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4292 -9.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -10.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2000 -11.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4292 -11.7708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3417 -11.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4125 -10.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -11.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4292 -12.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9708 -9.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9708 -11.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 22 36 2 0 0 0 0 2 37 1 1 0 0 0 38 37 1 1 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 38 1 0 0 0 0 43 44 1 6 0 0 0 42 45 1 1 0 0 0 41 46 1 1 0 0 0 47 44 1 1 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 47 1 0 0 0 0 24 53 1 0 0 0 0 52 54 1 6 0 0 0 51 55 1 6 0 0 0 49 56 1 6 0 0 0 50 57 1 1 0 0 0 M END > CFN90182 > Anemoside A3 > 129724-84-1 > 98% > C41H66O12 > 750.96 > White powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Anemoside-A3-CFN90182.html $$$$ -ISIS- 10201511232D 89 98 0 0 0 0 0 0 0 0999 V2000 3.4250 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1958 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1958 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -8.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7375 -7.3208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2833 -7.3208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2833 -6.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5083 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -6.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -7.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -6.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0500 -5.9875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7542 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9708 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -6.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -8.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 -9.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -5.0958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9708 -9.5458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7375 -8.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -5.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -3.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 -5.5417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -6.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8833 -8.6583 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8833 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -7.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3417 -7.7667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3417 -8.6583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1125 -9.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1125 -9.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4292 -9.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4292 -7.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3417 -10.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4292 -9.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -10.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2000 -11.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4292 -11.7708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3417 -11.3250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4125 -10.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -11.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4292 -12.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9708 -9.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9708 -11.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1333 -6.8750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1333 -7.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9042 -8.2125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.6750 -7.7667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.6750 -6.8750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.9042 -6.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4458 -6.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9042 -9.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1333 -9.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1333 -10.4375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3625 -10.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -11.7708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1333 -12.2167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.9042 -11.7708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.9042 -10.8792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.6750 -12.2167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 -12.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8250 -11.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1333 -13.1042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6750 -10.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4458 -8.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9042 -5.5417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3625 -13.5500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5917 -13.1042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -13.5500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8208 -14.4417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5917 -14.8875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3625 -14.4417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1333 -14.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5917 -15.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -13.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -14.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 12 1 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 17 22 1 1 0 0 0 11 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 27 18 1 0 0 0 0 4 28 1 6 0 0 0 10 29 1 6 0 0 0 14 13 1 0 0 0 0 11 9 1 0 0 0 0 27 26 1 0 0 0 0 27 30 1 6 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 12 33 1 1 0 0 0 18 34 1 6 0 0 0 22 35 1 0 0 0 0 22 36 2 0 0 0 0 2 37 1 1 0 0 0 38 37 1 1 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 38 1 0 0 0 0 43 44 1 6 0 0 0 42 45 1 1 0 0 0 41 46 1 1 0 0 0 47 44 1 1 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 47 1 0 0 0 0 24 53 1 0 0 0 0 52 54 1 6 0 0 0 51 55 1 6 0 0 0 49 56 1 6 0 0 0 50 57 1 1 0 0 0 58 35 1 1 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 58 1 0 0 0 0 62 64 1 1 0 0 0 60 65 1 1 0 0 0 65 66 1 0 0 0 0 67 66 1 1 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 72 1 0 0 0 0 72 67 1 0 0 0 0 71 73 1 1 0 0 0 69 74 1 1 0 0 0 74 75 1 0 0 0 0 70 76 1 6 0 0 0 72 77 1 6 0 0 0 61 78 1 6 0 0 0 63 79 1 6 0 0 0 80 76 1 1 0 0 0 80 81 1 0 0 0 0 81 82 1 0 0 0 0 82 83 1 0 0 0 0 83 84 1 0 0 0 0 84 85 1 0 0 0 0 85 80 1 0 0 0 0 85 86 1 6 0 0 0 84 87 1 6 0 0 0 82 88 1 6 0 0 0 83 89 1 1 0 0 0 M END > CFN99786 > Anemoside B4 > 129741-57-7 > 98% > C59H96O26 > 1221.38 > Powder > Triterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Anemoside-B4-CFN99786.html $$$$ -ISIS- 10201511232D 36 40 0 0 0 0 0 0 0 0999 V2000 3.6542 -6.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6542 -7.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4583 -7.6625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2625 -7.1958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2625 -6.2667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0708 -7.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -7.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -6.2667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0708 -5.8000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6792 -5.8000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6792 -4.8708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8750 -4.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0708 -4.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -6.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2917 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2917 -4.8708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4833 -4.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8458 -7.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9917 -8.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -6.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -8.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -3.4750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0958 -4.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 -3.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -3.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -3.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -2.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -8.1250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0708 -6.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -3.9417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -5.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9000 -4.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 -6.2667 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 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 9 1 0 0 0 0 10 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 11 1 0 0 0 0 2 18 2 0 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 8 21 1 1 0 0 0 16 22 1 1 0 0 0 10 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 16 26 1 0 0 0 0 26 27 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 6 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 4 31 1 6 0 0 0 9 32 1 6 0 0 0 11 33 1 1 0 0 0 17 34 1 6 0 0 0 1 5 1 0 0 0 0 35 22 1 0 0 0 0 22 36 2 0 0 0 0 M END > CFN98072 > 1-Decarboxy-3-oxo-ceanothic acid > 214150-74-0 > 98% > C29H44O3 > 440.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/1-Decarboxy-3-oxo-ceanothic-acid-CFN98072.html $$$$ -ISIS- 10201511232D 39 43 0 0 0 0 0 0 0 0999 V2000 3.6542 -6.2667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6542 -7.1958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4583 -7.6625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2625 -7.1958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2625 -6.2667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0708 -7.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -7.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -6.2667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0708 -5.8000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6792 -5.8000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6792 -4.8708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8750 -4.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0708 -4.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -6.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2917 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2917 -4.8708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4833 -4.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8458 -7.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9917 -8.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -6.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -8.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -3.4750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0958 -4.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 -3.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -3.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -3.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -2.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -8.1250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0708 -6.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -3.9417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -5.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0417 -6.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -4.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9000 -4.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 -6.2667 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 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 9 1 0 0 0 0 10 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 11 1 0 0 0 0 2 18 1 1 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 8 21 1 1 0 0 0 16 22 1 1 0 0 0 10 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 16 26 1 0 0 0 0 26 27 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 6 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 4 31 1 6 0 0 0 9 32 1 6 0 0 0 11 33 1 1 0 0 0 17 34 1 6 0 0 0 1 5 1 0 0 0 0 1 35 1 6 0 0 0 36 35 1 0 0 0 0 35 37 2 0 0 0 0 38 22 1 0 0 0 0 22 39 2 0 0 0 0 M END > CFN98063 > Ceanothic acid > 21302-79-4 > 98% > C30H46O5 > 486.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ceanothic-acid-CFN98063.html $$$$ -ISIS- 10201511232D 42 46 0 0 0 0 0 0 0 0999 V2000 3.6542 -6.2667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6542 -7.1958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4583 -7.6625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2625 -7.1958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2625 -6.2667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0708 -7.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -7.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -6.2667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0708 -5.8000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6792 -5.8000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6792 -4.8708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8750 -4.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0708 -4.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -6.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2917 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2917 -4.8708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4833 -4.4042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8458 -7.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9917 -8.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 -5.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -6.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -8.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -3.4750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0958 -4.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 -3.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -3.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -3.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -2.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -8.1250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0708 -6.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 -3.9417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -5.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -5.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0417 -6.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -4.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9000 -4.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 -6.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0417 -8.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -9.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2417 -7.6542 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 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 9 1 0 0 0 0 10 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 11 1 0 0 0 0 2 18 1 1 0 0 0 3 19 1 1 0 0 0 5 20 1 1 0 0 0 8 21 1 1 0 0 0 16 22 1 1 0 0 0 10 23 1 6 0 0 0 3 24 1 6 0 0 0 17 25 1 0 0 0 0 16 26 1 0 0 0 0 26 27 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 6 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 4 31 1 6 0 0 0 9 32 1 6 0 0 0 11 33 1 1 0 0 0 17 34 1 6 0 0 0 1 5 1 0 0 0 0 1 35 1 6 0 0 0 36 35 1 0 0 0 0 35 37 2 0 0 0 0 38 22 1 0 0 0 0 22 39 2 0 0 0 0 18 40 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 M END > CFN99309 > Ceanothic acid acetate > 119533-63-0 > 98% > C32H48O6 > 528.7 > Powder > Triterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Ceanothic-acid-acetate-CFN99309.html $$$$