记录说明
(2R,6R)-6-[(1R,3R,6S,8R,11S,12S,15R,16R)-6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-2-methyl-3-methylideneheptanoic acid 收自 NPASS。关联生物包括 Cystophora scalaris。
C31H50O3
式量由分子式和标准同位素质量计算,470.375995。
(2R,6R)-6-[(1R,3R,6S,8R,11S,12S,15R,16R)-6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-2-methyl-3-methylideneheptanoic acid 收自 NPASS。关联生物包括 Cystophora scalaris。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
C=C(CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@H](CC[C@]54C[C@]35CC[C@]12C)O)[C@@H](C)C(=O)O
InChIKey
FCQSIIVNJCMJLB-YIZNOSATSA-N
CAS:这里用的两张来源表里没有。
IUPAC
(2R,6R)-6-[(1R,3R,6S,8R,11S,12S,15R,16R)-6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-2-methyl-3-methylideneheptanoic acid