氢可他酯盐酸盐
[CAS# 125-03-1]

基本信息

• 产品名称: 氢可他酯盐酸盐
• 英文名: Hydrocortamate Hydrochloride
• 别名: [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] 2-Diethylaminoacetate Hydrochloride; 2-Diethylaminoacetic Acid [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester Hydrochloride; 2-Diethylaminoacetic Acid [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-3-Keto-10,13-Dimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Ester Hydrochloride
• 分子式: C₂₇H₄₂ClNO₆
• 分子量: 512.08
• CAS 登录号: 125-03-1
• EINECS 登录号: 204-723-4
• 分子行输入简码 SMILES: [C@]34([C@H]([C@H]2[C@@H]([C@@]1(C(=CC(=O)CC1)CC2)C)[C@@H](O)C3)CC[C@]4(O)C(=O)COC(=O)CN(CC)CC)C.[H+].[Cl-]
• 国际化学标识码 InChI: 1S/C27H41NO6.ClH/c1-5-28(6-2)15-23(32)34-16-22(31)27(33)12-10-20-19-8-7-17-13-18(29)9-11-25(17,3)24(19)21(30)14-26(20,27)4;/h13,19-21,24,30,33H,5-12,14-16H2,1-4H3;1H/t19-,20-,21-,24+,25-,26-,27-;/m0./s1
• 国际化学标识检索码 InChIKey: AKQNAIYKSALPKV-OYHXESGYSA-N

物理化学性质

• 沸点: 627.2°C at 760 mmHg （计算值）
• 闪点: 333.1°C （计算值）