957466-16-9 (胡克酰胺I,hookerianamide I)

快速询单

结构式：

胡克酰胺IMOL文件

CAS号：

957466-16-9

中文名称：

胡克酰胺I

英文名称：

hookerianamide I

分子式：

C₃₀H₄₆N₂O

分子量：

450.699048519135

植物源：

羽脉野扇花

胡克酰胺I(957466-16-9)名称与标识符

名称

英文别名：

hookerianamide I;20(N-methylamino)-3beta-(N-methylbenzamido)-5alpha-pregnane;957466-16-9;CHEBI:66021;DTXSID601176585;Q27134524;CHEMBL503323;N-methyl-N-[(3beta,5alpha,20S)-20-(methylamino)pregnan-3-yl]benzamide;N-Methyl-N-[(3I(2),5I+/-,20S)-20-(methylamino)pregnan-3-yl]benzamide;N-Methyl-N-((3beta,5alpha,20S)-20-(methylamino)pregnan-3-yl)benzamide;N-[(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-17-[(1S)-1-(methylamino)ethyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]-N-methylbenzamide;N-((3S,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-17-((1S)-1-(methylamino)ethyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta(a)phenanthren-3-yl)-N-methylbenzamide;

标识符

InChIKey：

NISGMKNSSUMSSN-IBWRYCSWSA-N

Inchi：

1S/C30H46N2O/c1-20(31-4)25-13-14-26-24-12-11-22-19-23(32(5)28(33)21-9-7-6-8-10-21)15-17-29(22,2)27(24)16-18-30(25,26)3/h6-10,20,22-27,31H,11-19H2,1-5H3/t20-,22-,23-,24-,25+,26-,27-,29-,30+/m0/s1

SMILES：

O=C(C1C=CC=CC=1)N(C)[C@H]1CC[C@@]2(C)[C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)NC)CC[C@@H]12