-ISIS- 10201511232D 19 18 0 0 0 0 0 0 0 0999 V2000 1.6208 -6.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -6.4458 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1792 -6.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 -6.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -6.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -6.4458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2833 -6.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0583 -6.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8292 -6.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -6.4458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3833 -6.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1625 -6.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -5.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -5.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6083 -5.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9417 -6.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7125 -6.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4875 -6.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7125 -5.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 1 0 0 0 0 2 13 1 0 0 0 0 6 14 1 1 0 0 0 10 15 1 1 0 0 0 16 12 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 17 19 2 0 0 0 0 M END > CFN97734 > Phytone > 502-69-2 > 98% > C18H36O > 268.48 > Oil > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Phytone-CFN97734.html $$$$ -ISIS- 10201511232D 21 20 0 0 0 0 0 0 0 0999 V2000 -3.2542 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -5.0417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6958 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9167 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6292 -5.0417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4083 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1833 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7333 -5.0417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5083 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2875 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6292 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7333 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0667 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8375 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6125 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8375 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3875 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1667 -5.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 1 0 0 0 0 2 13 1 0 0 0 0 6 14 1 1 0 0 0 10 15 1 1 0 0 0 16 12 1 0 0 0 0 17 16 1 0 0 0 0 18 17 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 M END > CFN99630 > Phytol > 150-86-7 > 98% > C20H40O > 296.5 > Oil > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Phytol-CFN99630.html $$$$ -ISIS- 10201511232D 24 23 0 0 0 0 0 0 0 0999 V2000 -3.2542 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6958 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9167 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6292 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4083 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1833 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7333 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5083 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2875 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6292 -4.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0667 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8375 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6125 -5.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3875 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1667 -5.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2542 -6.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0292 -5.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5083 -6.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6125 -6.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3875 -4.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 2 0 0 0 0 4 3 1 0 0 0 0 5 4 2 0 0 0 0 6 5 1 0 0 0 0 7 6 2 0 0 0 0 8 7 1 0 0 0 0 9 8 2 0 0 0 0 10 9 1 0 0 0 0 11 10 2 0 0 0 0 12 11 1 0 0 0 0 2 13 1 0 0 0 0 6 14 1 0 0 0 0 15 12 2 0 0 0 0 16 15 1 0 0 0 0 17 16 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 1 20 2 0 0 0 0 1 21 1 0 0 0 0 11 22 1 0 0 0 0 17 23 1 0 0 0 0 18 24 2 0 0 0 0 M END > CFN90226 > Croceic acid > 27876-94-4 > 98% > C20H24O4 > 328.40 > Red cryst. > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Croceic-acid-CFN90226.html $$$$ -ISIS- 10201511232D 24 25 0 0 0 0 0 0 0 0999 V2000 2.5833 -5.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5833 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 -7.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1542 -6.7708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1542 -5.8667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 -5.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9375 -7.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7208 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5042 -7.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2875 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0708 -7.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8583 -6.7708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6417 -7.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 -4.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7208 -5.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8583 -5.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -7.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -6.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2083 -7.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6417 -8.1292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2083 -8.1292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.9917 -6.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1125 -8.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2083 -9.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 7 4 1 0 0 0 0 8 7 2 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 1 0 0 0 0 13 12 1 0 0 0 0 6 14 2 0 0 0 0 8 15 1 0 0 0 0 12 16 1 0 0 0 0 2 17 1 0 0 0 0 13 18 2 0 0 0 0 18 19 1 0 0 0 0 13 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 19 22 2 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 M END > CFN97516 > Nemoralisin > 942480-13-9 > 98% > C20H28O4 > 332.4 > Powder > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Nemoralisin-CFN97516.html $$$$ -ISIS- 10201511232D 22 22 0 0 0 0 0 0 0 0999 V2000 0.0500 -6.0500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0500 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8292 -7.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6042 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6042 -6.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8292 -5.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5833 -5.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8167 -6.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3833 -5.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8292 -4.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6042 -4.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6042 -3.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3792 -2.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8292 -2.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3792 -2.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1583 -1.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1583 -0.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9333 -0.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3833 -0.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9333 0.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1583 1.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 1.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 7 1 1 0 0 0 1 8 1 6 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M END > CFN90026 > Retinoic acid > 302-79-4 > 98% > C20H28O2 > 300.44 > Yellow powder > Diterpenoids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Retinoic-acid-CFN90026.html $$$$ -ISIS- 10201511232D 68 71 0 0 0 0 0 0 0 0999 V2000 0.6792 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1167 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5417 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2583 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1167 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8292 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -6.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2583 -6.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2667 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6875 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4042 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1208 -7.3583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6792 -8.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0333 -6.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6875 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4042 -6.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1208 -8.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0333 -6.1208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6833 -5.7083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -4.8792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0333 -4.4667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7500 -4.8792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7500 -5.7083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4042 -8.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4042 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.1208 -9.8375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.8375 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8375 -8.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4625 -4.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3958 -4.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5500 -9.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6917 -9.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4625 -6.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0333 -3.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1208 -10.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5500 -8.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1125 -4.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8292 -4.4667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5458 -4.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2625 -4.4667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2625 -3.6417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5458 -3.2292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8292 -3.6417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5458 -2.4042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -4.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1167 -3.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -3.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6917 -4.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -9.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2625 -9.8375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5458 -9.4250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8292 -9.8375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8292 -10.6625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5458 -11.0792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2625 -10.6625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5458 -11.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1125 -9.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1125 -11.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -11.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -9.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 2 0 0 0 0 4 3 1 0 0 0 0 5 4 2 0 0 0 0 6 5 1 0 0 0 0 7 6 2 0 0 0 0 8 7 1 0 0 0 0 9 8 2 0 0 0 0 10 9 1 0 0 0 0 11 10 2 0 0 0 0 12 11 1 0 0 0 0 2 13 1 0 0 0 0 6 14 1 0 0 0 0 15 12 2 0 0 0 0 16 15 1 0 0 0 0 17 16 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 1 20 2 0 0 0 0 1 21 1 0 0 0 0 11 22 1 0 0 0 0 17 23 1 0 0 0 0 18 24 2 0 0 0 0 25 19 1 1 0 0 0 26 21 1 1 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 26 1 0 0 0 0 25 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 25 1 0 0 0 0 30 37 1 1 0 0 0 28 38 1 1 0 0 0 35 39 1 1 0 0 0 33 40 1 1 0 0 0 31 41 1 6 0 0 0 29 42 1 6 0 0 0 34 43 1 6 0 0 0 36 44 1 6 0 0 0 38 45 1 0 0 0 0 46 45 1 1 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 46 1 0 0 0 0 50 52 1 1 0 0 0 48 53 1 1 0 0 0 51 54 1 6 0 0 0 49 55 1 6 0 0 0 53 56 1 0 0 0 0 40 57 1 0 0 0 0 58 57 1 1 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 58 1 0 0 0 0 62 64 1 1 0 0 0 60 65 1 1 0 0 0 61 66 1 6 0 0 0 63 67 1 6 0 0 0 65 68 1 0 0 0 0 M END > CFN99927 > Crocin I > 94238-00-3 > 98% > C44H64O24 > 976.96 > Powder > Diterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Crocin-CFN99927.html $$$$ -ISIS- 10201511232D 57 59 0 0 0 0 0 0 0 0999 V2000 0.6792 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1167 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5417 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2583 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6875 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1167 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8292 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -6.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2583 -6.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2667 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6875 -7.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4042 -6.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1208 -7.3583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6792 -8.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0333 -6.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8292 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6875 -8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4042 -6.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1208 -8.1833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0333 -6.1208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6833 -5.7083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -4.8792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0333 -4.4667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7500 -4.8792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7500 -5.7083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4042 -8.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4042 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.1208 -9.8375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.8375 -9.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8375 -8.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4625 -4.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3958 -4.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5500 -9.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6917 -9.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4625 -6.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0333 -3.6417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1208 -10.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5500 -8.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1125 -4.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8292 -4.4667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5458 -4.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2625 -4.4667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2625 -3.6417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5458 -3.2292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8292 -3.6417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5458 -2.4042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -4.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1167 -3.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -3.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6917 -4.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6917 -10.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 2 0 0 0 0 4 3 1 0 0 0 0 5 4 2 0 0 0 0 6 5 1 0 0 0 0 7 6 2 0 0 0 0 8 7 1 0 0 0 0 9 8 2 0 0 0 0 10 9 1 0 0 0 0 11 10 2 0 0 0 0 12 11 1 0 0 0 0 2 13 1 0 0 0 0 6 14 1 0 0 0 0 15 12 2 0 0 0 0 16 15 1 0 0 0 0 17 16 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 1 20 2 0 0 0 0 1 21 1 0 0 0 0 11 22 1 0 0 0 0 17 23 1 0 0 0 0 18 24 2 0 0 0 0 25 19 1 1 0 0 0 26 21 1 1 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 26 1 0 0 0 0 25 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 25 1 0 0 0 0 30 37 1 1 0 0 0 28 38 1 1 0 0 0 35 39 1 1 0 0 0 33 40 1 1 0 0 0 31 41 1 6 0 0 0 29 42 1 6 0 0 0 34 43 1 6 0 0 0 36 44 1 6 0 0 0 38 45 1 0 0 0 0 46 45 1 1 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 46 1 0 0 0 0 50 52 1 1 0 0 0 48 53 1 1 0 0 0 51 54 1 6 0 0 0 49 55 1 6 0 0 0 53 56 1 0 0 0 0 40 57 1 0 0 0 0 M END > CFN99928 > Crocin II > 55750-84-0 > 98% > C38H54O19 > 814.83 > Dark red powder > Diterpenoids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Crocin-CFN99928.html $$$$