(1a,7a,17b)-1,7-二(乙酰基硫代)-17-羟基-17-甲基-雄甾-4-烯-3-酮
[CAS# 2205-73-4]

基本信息

• 产品名称: (1a,7a,17b)-1,7-二(乙酰基硫代)-17-羟基-17-甲基-雄甾-4-烯-3-酮
• 英文名: (1a,7a,17b)-1,7-Bis(acetylthio)-17-hydroxy-17-methyl-Androst-4-en-3-one
• 别名: Ethanethioic Acid S-[[(1S,7R,8S,9S,10R,13S,14S,17S)-1-(Acetylthio)-17-Hydroxy-10,13,17-Trimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-7-Yl]] Ester; Ethanethioic Acid S-[[(1S,7R,8S,9S,10R,13S,14S,17S)-1-(Acetylthio)-17-Hydroxy-3-Keto-10,13,17-Trimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-7-Yl]] Ester; S-[[(1S,7R,8S,9S,10R,13S,14S,17S)-1-Ethanoylsulfanyl-17-Hydroxy-10,13,17-Trimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-7-Yl]] Ethanethioate
• 分子式: C₂₄H₃₄O₄S₂
• 分子量: 450.65
• CAS 登录号: 2205-73-4
• EINECS 登录号: 218-614-4
• 分子行输入简码 SMILES: [C@H]23[C@@H]([C@@]1(C(=CC(=O)C[C@@H]1SC(C)=O)C[C@H]2SC(C)=O)C)CC[C@]4([C@H]3CC[C@]4(C)O)C
• 国际化学标识码 InChI: 1S/C24H34O4S2/c1-13(25)29-19-11-15-10-16(27)12-20(30-14(2)26)24(15,5)18-6-8-22(3)17(21(18)19)7-9-23(22,4)28/h10,17-21,28H,6-9,11-12H2,1-5H3/t17-,18-,19+,20-,21-,22-,23-,24-/m0/s1
• 国际化学标识检索码 InChIKey: YUOZKOLALXNELS-SQVYRKCQSA-N

物理化学性质

• 密度: 1.251g/cm³ （计算值）
• 沸点: 588.088°C at 760 mmHg （计算值）
• 闪点: 309.465°C （计算值）