3alpha-乙酰氧基-7alpha,12alpha-二羟基-5beta-胆烷-24-酸甲酯
[CAS# 7443-91-6]

基本信息

• 产品名称: 3alpha-乙酰氧基-7alpha,12alpha-二羟基-5beta-胆烷-24-酸甲酯
• 英文名: 3alpha-Acetyloxy-7alpha,12alpha-Dihydroxy-5beta-Cholan-24-Oic Acid Methyl Ester
• 别名: Methyl 4-(3-Acetoxy-7,12-Dihydroxy-10,13-Dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl)Pentanoate; 4-(3-Acetoxy-7,12-Dihydroxy-10,13-Dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl)Pentanoic Acid Methyl Ester; 4-(3-Acetoxy-7,12-Dihydroxy-10,13-Dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl)Valeric Acid Methyl Ester
• 分子式: C₂₇H₄₄O₆
• 分子量: 464.64
• CAS 登录号: 7443-91-6
• 分子行输入简码 SMILES: C(C(C4C3(C(C2C(C1(C(CC(OC(C)=O)CC1)CC2O)C)CC3O)CC4)C)C)CC(OC)=O
• 国际化学标识码 InChI: 1S/C27H44O6/c1-15(6-9-24(31)32-5)19-7-8-20-25-21(14-23(30)27(19,20)4)26(3)11-10-18(33-16(2)28)12-17(26)13-22(25)29/h15,17-23,25,29-30H,6-14H2,1-5H3
• 国际化学标识检索码 InChIKey: RYUNWMNMODIREU-UHFFFAOYSA-N

物理化学性质

• 密度: 1.155g/cm³ （计算值）
• 沸点: 550.692°C at 760 mmHg （计算值）
• 闪点: 172.908°C （计算值）