(3α,5β,7α,12α)-Cholane-3,7,12,24-tetrol 3,7,12-Triformate(96736-29-7)名称与标识符
名称
英文别名:
(3α,5β,7α,12α)-Cholane-3,7,12,24-tetrol 3,7,12-Triformate;Cholane-3,7,12,24-tetrol, 3,7,12-triformate, (3α,5β,7α,12α)- (9CI);
标识符
InChIKey:
UIEBFQHIAGFERQ-XJZYBRFWSA-N
Inchi:
1S/C27H42O7/c1-17(5-4-10-28)20-6-7-21-25-22(13-24(34-16-31)27(20,21)3)26(2)9-8-19(32-14-29)11-18(26)12-23(25)33-15-30/h14-25,28H,4-13H2,1-3H3/t17-,18+,19-,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1
SMILES:
[C@H]1(OC=O)C[C@]2([H])[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@]([C@@H](OC=O)C1)(C)[C@@H]([C@H](C)CCCO)CC3)[C@H](OC=O)C2