3beta-(乙酰氧基)-5alpha-羊毛甾烷-7,11-二酮
[CAS# 6593-12-0]

基本信息

• 产品名称: 3beta-(乙酰氧基)-5alpha-羊毛甾烷-7,11-二酮
• 英文名: 3beta-(Acetyloxy)-5alpha-Lanostane-7,11-Dione
• 别名: [(3S,5R,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-Dimethylhexyl]-4,4,10,13,14-Pentamethyl-7,11-Dioxo-2,3,5,6,8,9,12,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Acetate; Acetic Acid [(3S,5R,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-Dimethylhexyl]-4,4,10,13,14-Pentamethyl-7,11-Dioxo-2,3,5,6,8,9,12,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Ester; Acetic Acid [(3S,5R,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-Dimethylhexyl]-7,11-Diketo-4,4,10,13,14-Pentamethyl-2,3,5,6,8,9,12,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Ester
• 分子式: C₃₂H₅₂O₄
• 分子量: 500.76
• CAS 登录号: 6593-12-0
• 分子行输入简码 SMILES: [C@H](CCCC(C)C)(C)[C@@H]3[C@]2(CC(=O)[C@@H]1[C@@]4([C@@H](CC(=O)[C@H]1[C@@]2(CC3)C)C(C)(C)[C@@H](OC(=O)C)CC4)C)C
• 国际化学标识码 InChI: 1S/C32H52O4/c1-19(2)11-10-12-20(3)22-13-16-31(8)28-23(34)17-25-29(5,6)26(36-21(4)33)14-15-30(25,7)27(28)24(35)18-32(22,31)9/h19-20,22,25-28H,10-18H2,1-9H3/t20-,22-,25+,26+,27+,28-,30+,31+,32-/m1/s1
• 国际化学标识检索码 InChIKey: WFKYHSDKVGOEMG-BYOCFGTCSA-N

物理化学性质

• 密度: 1.046g/cm³ （计算值）
• 沸点: 556.148°C at 760 mmHg （计算值）
• 闪点: 229.655°C （计算值）