记录说明
(3S,5S,9R,10S,13R,14R,17R)-17-[(E,2S,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol 收自 NPASS。关联生物包括 Chondrus yendoi、Aeodes ulvoidea。
C29H48O
式量由分子式和标准同位素质量计算,412.370516。
(3S,5S,9R,10S,13R,14R,17R)-17-[(E,2S,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol 收自 NPASS。关联生物包括 Chondrus yendoi、Aeodes ulvoidea。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
CC[C@H](/C=C/[C@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)O)C(C)C
InChIKey
JZVFJDZBLUFKCA-GQUMXWHRSA-N
CAS:这里用的两张来源表里没有。
IUPAC
(3S,5S,9R,10S,13R,14R,17R)-17-[(E,2S,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol