记录说明
(1R,4aS,5R,6R,8aR)-6-methoxy-1,4a,6-trimethyl-5-[(3S)-3-methylpentyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid 收自 NPASS。关联生物包括 Fucus spiralis。
C21H38O3
式量由分子式和标准同位素质量计算,338.282095。
(1R,4aS,5R,6R,8aR)-6-methoxy-1,4a,6-trimethyl-5-[(3S)-3-methylpentyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid 收自 NPASS。关联生物包括 Fucus spiralis。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
CC[C@H](C)CC[C@@H]1[C@@]2(C)CCC[C@](C)([C@@H]2CC[C@@]1(C)OC)C(=O)O
InChIKey
CKMWUCWNXKEVER-VLWQACTDSA-N
CAS:这里用的两张来源表里没有。
IUPAC
(1R,4aS,5R,6R,8aR)-6-methoxy-1,4a,6-trimethyl-5-[(3S)-3-methylpentyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid