记录说明
(1R,4aR,6aS,6aS,6bR,8aR,9R,10R,11R,12S,12aR,14bS)-1,10,11,12-tetrahydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-c 收自 NPASS。关联生物包括 Laurencia composita。
C30H48O7
式量由分子式和标准同位素质量计算,520.340004。
(1R,4aR,6aS,6aS,6bR,8aR,9R,10R,11R,12S,12aR,14bS)-1,10,11,12-tetrahydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-c 收自 NPASS。关联生物包括 Laurencia composita。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@H]4[C@@]3(C)CC[C@H]3[C@](C)(CO)[C@H]([C@@H]([C@H]([C@]43C)O)O)O)[C@@H]2[C@H]1O)C(=O)O
InChIKey
FUSZINQYRKOTIV-CQBIVLAESA-N
CAS:这里用的两张来源表里没有。
IUPAC
(1R,4aR,6aS,6aS,6bR,8aR,9R,10R,11R,12S,12aR,14bS)-1,10,11,12-tetrahydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid