记录说明
[(2S,3S,4R,5R,8R,9S,10R,13S,14R,17S)-4-acetyloxy-3-benzamido-17-[(1S)-1-(dimethylamino)ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenan 收自 NPASS。关联生物包括 Lenormandia smithiae。
C34H50N2O5
式量由分子式和标准同位素质量计算,566.371973。
[(2S,3S,4R,5R,8R,9S,10R,13S,14R,17S)-4-acetyloxy-3-benzamido-17-[(1S)-1-(dimethylamino)ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenan 收自 NPASS。关联生物包括 Lenormandia smithiae。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
C[C@@H]([C@H]1CC[C@@H]2[C@H]3CC[C@H]4[C@H]([C@H]([C@H](C[C@]4(C)[C@H]3CC[C@]12C)OC(=O)C)N=C(c1ccccc1)O)OC(=O)C)N(C)C
InChIKey
XMPJZLCGQZNLBK-CNCXSLJASA-N
CAS:这里用的两张来源表里没有。
IUPAC
[(2S,3S,4R,5R,8R,9S,10R,13S,14R,17S)-4-acetyloxy-3-benzamido-17-[(1S)-1-(dimethylamino)ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl] acetate