记录说明
(1R,3aR,5aR,5bS,7aR,9R,11aR,11bS,13aS,13bS)-3a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-2,3,4,5,5a,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydro-1H-cyclopenta[a]chrysen-9-ol 收自 NPASS。关联生物包括 Pterocladiella capillacea。
C29H48O
式量由分子式和标准同位素质量计算,412.370516。
(1R,3aR,5aR,5bS,7aR,9R,11aR,11bS,13aS,13bS)-3a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-2,3,4,5,5a,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydro-1H-cyclopenta[a]chrysen-9-ol 收自 NPASS。关联生物包括 Pterocladiella capillacea。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
C=C(C)[C@@H]1CC[C@]2(C)CC[C@@H]3[C@H](CC[C@H]4[C@@]3(C)CC[C@H]3C(C)(C)[C@@H](CC[C@]43C)O)[C@@H]12
InChIKey
WZKZWFVXLFHXFB-OODYEAGWSA-N
CAS:这里用的两张来源表里没有。
IUPAC
(1R,3aR,5aR,5bS,7aR,9R,11aR,11bS,13aS,13bS)-3a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-2,3,4,5,5a,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydro-1H-cyclopenta[a]chrysen-9-ol