(4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-羟基-10,13-二甲基-2,3,4,5,6,7,8,9,11,12,14,15,16,17-十四氢-1H-环戊并[a]菲-17-基]戊酸
[CAS# 1534-35-6]

基本信息

• 产品名称: (4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-羟基-10,13-二甲基-2,3,4,5,6,7,8,9,11,12,14,15,16,17-十四氢-1H-环戊并[a]菲-17-基]戊酸
• 英文名: (4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-Hydroxy-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
• 别名: (4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-Hydroxy-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; (3Beta,5Beta)-3-Hydroxycholan-24-Oic Acid; Cholan-24-Oic Acid, 3-Hydroxy-, (3Beta,5Beta)-
• 分子式: C₂₄H₄₀O₃
• 分子量: 376.58
• CAS 登录号: 1534-35-6
• 分子行输入简码 SMILES: [C@@H]1(CC[C@]3([C@@H](C1)CC[C@H]4[C@@H]2CC[C@H]([C@@H](CCC(=O)O)C)[C@@]2(C)CC[C@H]34)C)O
• 国际化学标识码 InChI: 1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16-,17+,18+,19-,20+,21+,23+,24-/m1/s1
• 国际化学标识检索码 InChIKey: SMEROWZSTRWXGI-WFVDQZAMSA-N

物理化学性质

• 密度: 1.073g/cm³ （计算值）
• 沸点: 510.992°C at 760 mmHg （计算值）
• 闪点: 276.926°C （计算值）