记录说明
(1R,2S,4aS,6aR,6aS,6bS,8aS,10S,12aR,14bR)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid 收自 NPASS。关联生物包括 Oscillatoria princeps。
C30H48O3
式量由分子式和标准同位素质量计算,456.360345。
(1R,2S,4aS,6aR,6aS,6bS,8aS,10S,12aR,14bR)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid 收自 NPASS。关联生物包括 Oscillatoria princeps。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
C[C@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](C(C)(C)[C@H]5CC[C@]34C)O)[C@H]2[C@@H]1C)C(=O)O
InChIKey
WCGUUGGRBIKTOS-FTBVRPNCSA-N
CAS:这里用的两张来源表里没有。
IUPAC
(1R,2S,4aS,6aR,6aS,6bS,8aS,10S,12aR,14bR)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid