-ISIS- 10201511232D 38 42 0 0 0 0 0 0 0 0999 V2000 0.5333 -11.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -11.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3292 -12.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1208 -11.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1208 -11.0042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3292 -10.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9208 -12.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7167 -11.9167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7167 -11.0042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9208 -10.5458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5167 -10.5458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5167 -9.6250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7167 -9.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9208 -9.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1042 -10.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1042 -9.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3042 -9.1667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3292 -9.6250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1208 -10.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5083 -12.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5167 -8.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5167 -11.4583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7167 -10.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3042 -8.2458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1042 -7.7875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5167 -7.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -8.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6917 -7.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6917 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -6.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1042 -6.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -5.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -6.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2833 -6.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 -8.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1042 -8.7083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3042 -7.3292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9208 -11.4583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 11 15 1 0 0 0 0 6 18 2 0 0 0 0 5 19 1 1 0 0 0 8 20 1 6 0 0 0 12 21 1 1 0 0 0 11 22 1 6 0 0 0 9 23 1 1 0 0 0 17 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 6 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 25 1 0 0 0 0 30 32 1 0 0 0 0 29 33 1 0 0 0 0 33 34 1 0 0 0 0 28 35 2 0 0 0 0 17 36 1 6 0 0 0 25 37 1 6 0 0 0 10 38 1 6 0 0 0 M END > CFN97467 > Daturataturin A aglycone > 904665-71-0 > 98% > C28H38O5 > 454.6 > Powder > Steroids > Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc. > http://www.chemfaces.com/natural/Daturataturin-A-aglycone-CFN97467.html $$$$ -ISIS- 10201511232D 49 54 0 0 0 0 0 0 0 0999 V2000 0.5333 -10.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -11.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -11.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0083 -11.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0083 -10.6208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2750 -10.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7542 -11.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -11.4708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4958 -10.6208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7542 -10.1917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2375 -10.1917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2375 -9.3375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4958 -8.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7542 -9.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -10.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -9.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -8.9125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2750 -9.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0083 -9.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2292 -11.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2375 -8.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2375 -11.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -9.7667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -8.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7167 -7.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2375 -7.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -8.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1958 -7.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1958 -6.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -6.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -5.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9292 -6.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6708 -6.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9292 -8.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -8.4833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -7.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7542 -11.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4083 -6.3417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1500 -6.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8875 -6.3417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8875 -5.4833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1500 -5.0708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4083 -5.4833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1583 -4.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6250 -6.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6708 -5.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6250 -5.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3667 -6.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 11 15 1 0 0 0 0 6 18 2 0 0 0 0 5 19 1 1 0 0 0 8 20 1 6 0 0 0 12 21 1 1 0 0 0 11 22 1 6 0 0 0 9 23 1 1 0 0 0 17 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 6 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 25 1 0 0 0 0 30 32 1 0 0 0 0 29 33 1 0 0 0 0 33 34 1 0 0 0 0 28 35 2 0 0 0 0 17 36 1 6 0 0 0 25 37 1 6 0 0 0 10 38 1 6 0 0 0 39 34 1 1 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 39 1 0 0 0 0 43 45 1 1 0 0 0 41 46 1 1 0 0 0 44 47 1 6 0 0 0 42 48 1 6 0 0 0 46 49 1 0 0 0 0 M END > CFN97468 > Daturametelin I > 904667-65-8 > 98% > C34H48O10 > 616.8 > Powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Daturametelin-I-CFN97468.html $$$$ -ISIS- 10201511232D 49 54 0 0 0 0 0 0 0 0999 V2000 0.5333 -10.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -11.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -11.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0083 -11.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0083 -10.6208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2750 -10.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7542 -11.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -11.4708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4958 -10.6208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7542 -10.1917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2375 -10.1917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2375 -9.3375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4958 -8.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7542 -9.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -10.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -9.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -8.9125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2750 -9.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0083 -9.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2292 -11.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2375 -8.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2375 -11.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -9.7667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -8.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7167 -7.6292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2375 -7.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -8.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1958 -7.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1958 -6.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -6.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -6.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -5.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9292 -6.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6708 -6.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9292 -8.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -8.4833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -7.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7542 -11.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4083 -6.3417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1500 -6.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8875 -6.3417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8875 -5.4833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1500 -5.0708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4083 -5.4833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1583 -4.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6250 -6.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6708 -5.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6250 -5.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3667 -6.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 11 15 1 0 0 0 0 6 18 2 0 0 0 0 5 19 1 1 0 0 0 8 20 1 6 0 0 0 12 21 1 1 0 0 0 11 22 1 6 0 0 0 9 23 1 1 0 0 0 17 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 6 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 25 1 0 0 0 0 30 32 1 0 0 0 0 29 33 1 0 0 0 0 33 34 1 0 0 0 0 28 35 2 0 0 0 0 17 36 1 6 0 0 0 25 37 1 6 0 0 0 10 38 1 6 0 0 0 39 34 1 1 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 39 1 0 0 0 0 43 45 1 1 0 0 0 41 46 1 1 0 0 0 44 47 1 6 0 0 0 42 48 1 6 0 0 0 46 49 1 0 0 0 0 M END > CFN99414 > Daturataturin A > 133360-51-7 > 98% > C34H48O10 > 616.8 > Powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Daturataturin-A-CFN99414.html $$$$