(3S,10S,13R,14S,17R)-3-羟基-4,4,10,13-四甲基-17-[(2R)-6-甲基庚-5-烯-2-基]-2,3,5,6,7,11,12,15,16,17-十氢-1H-环戊二烯并[a]菲-14-羧酸
[CAS# 116424-94-3]

基本信息

• 产品名称: (3S,10S,13R,14S,17R)-3-羟基-4,4,10,13-四甲基-17-[(2R)-6-甲基庚-5-烯-2-基]-2,3,5,6,7,11,12,15,16,17-十氢-1H-环戊二烯并[a]菲-14-羧酸
• 英文名: (3S,10S,13R,14S,17R)-3-Hydroxy-4,4,10,13-Tetramethyl-17-[(2R)-6-Methylhept-5-En-2-Yl]-2,3,5,6,7,11,12,15,16,17-Decahydro-1H-Cyclopenta[a]Phenanthrene-14-Carboxylic Acid
• 别名: (3S,10S,13R,14S,17R)-17-[(1R)-1,5-Dimethylhex-4-Enyl]-3-Hydroxy-4,4,10,13-Tetramethyl-2,3,5,6,7,11,12,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthrene-14-Carboxylic Acid; (3Beta)-3-Hydroxylanosta-8,24-Dien-30-Oic Acid; Lanosta-8,24-Dien-30-Oic Acid, 3-Hydroxy-, (3Beta)-
• 分子式: C₃₀H₄₈O₃
• 分子量: 456.71
• CAS 登录号: 116424-94-3
• 分子行输入简码 SMILES: [C@@]12([C@@]([C@H](CC1)[C@@H](CCC=C(C)C)C)(CCC3=C2CCC4[C@@]3(CC[C@H](O)C4(C)C)C)C)C(=O)O
• 国际化学标识码 InChI: 1S/C30H48O3/c1-19(2)9-8-10-20(3)21-14-18-30(26(32)33)23-11-12-24-27(4,5)25(31)15-16-28(24,6)22(23)13-17-29(21,30)7/h9,20-21,24-25,31H,8,10-18H2,1-7H3,(H,32,33)/t20-,21-,24?,25+,28-,29-,30+/m1/s1
• 国际化学标识检索码 InChIKey: HVQPUBROUXVNPN-KHXUTHGGSA-N

物理化学性质

• 密度: 1.072g/cm³ （计算值）
• 沸点: 559.601°C at 760 mmHg （计算值）
• 闪点: 306.291°C （计算值）