记录说明
(3S,5R,8S,10S,13R,14S,17R)-17-[(2R,5R)-5-hydroxy-6-methylhept-6-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,8,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol 收自 NPASS。关联生物包括 Oscillatoria raoi。
C30H50O2
式量由分子式和标准同位素质量计算,442.381081。
(3S,5R,8S,10S,13R,14S,17R)-17-[(2R,5R)-5-hydroxy-6-methylhept-6-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,8,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol 收自 NPASS。关联生物包括 Oscillatoria raoi。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
C=C(C)[C@@H](CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@H](CC[C@]4(C)C3=CC[C@]12C)O)O
InChIKey
CISYXFSTZZQVIH-NIYAVATFSA-N
CAS:这里用的两张来源表里没有。
IUPAC
(3S,5R,8S,10S,13R,14S,17R)-17-[(2R,5R)-5-hydroxy-6-methylhept-6-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,8,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol