(1R,20'S)-20'-二甲基氨基-2-甲基螺[1H-异吲哚-1,3'-[5alpha]孕甾烷]-3(2H)-酮
[CAS# 19587-41-8]

基本信息

• 产品名称: (1R,20'S)-20'-二甲基氨基-2-甲基螺[1H-异吲哚-1,3'-[5alpha]孕甾烷]-3(2H)-酮
• 英文名: (1R,20'S)-20'-Dimethylamino-2-Methylspiro[1H-Isoindole-1,3'-[5alpha]Pregnan]-3(2H)-One
• 别名: (3R,10S,13S,17S)-17-[(1S)-1-Dimethylaminoethyl]-2',10,13-Trimethyl-Spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydrocyclopenta[A]Phenanthrene-3,3'-Isoindoline]-1'-One; (3R,10S,13S,17S)-17-[(1S)-1-Dimethylaminoethyl]-2',10,13-Trimethyl-1'-Spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydrocyclopenta[A]Phenanthrene-3,3'-Isoindoline]One; (3R,10S,13S,17S)-17-[(1S)-1-Dimethylaminoethyl]-2',10,13-Trimethyl-Spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydrocyclopenta[A]Phenanthrene-3,3'-Isoindole]-1'-One
• 分子式: C₃₁H₄₆N₂O
• 分子量: 462.72
• CAS 登录号: 19587-41-8
• 分子行输入简码 SMILES: [C@]16(N(C(=O)C2=C1C=CC=C2)C)CC5CCC4C3CC[C@@H]([C@]3(CCC4[C@]5(CC6)C)C)[C@@H](N(C)C)C
• 国际化学标识码 InChI: 1S/C31H46N2O/c1-20(32(4)5)24-13-14-25-22-12-11-21-19-31(27-10-8-7-9-23(27)28(34)33(31)6)18-17-29(21,2)26(22)15-16-30(24,25)3/h7-10,20-22,24-26H,11-19H2,1-6H3/t20-,21?,22?,24+,25?,26?,29-,30+,31+/m0/s1
• 国际化学标识检索码 InChIKey: SLGWGPQWJRVPAD-BOCAEJFZSA-N

物理化学性质

• 密度: 1.109g/cm³ （计算值）
• 沸点: 567.717°C at 760 mmHg （计算值）
• 闪点: 211.058°C （计算值）