(2S,3S,4S,5R,6S)-3,4,5-三羟基-6-[[(8S,9S,13S,14S)-2-甲氧基-13-甲基-17-氧代-7,8,9,11,12,14,15,16-八氢-6H-环戊二烯并[a]菲-3-基]氧基]四氢吡喃-2-羧酸
[CAS# 25577-70-2]

基本信息

• 产品名称: (2S,3S,4S,5R,6S)-3,4,5-三羟基-6-[[(8S,9S,13S,14S)-2-甲氧基-13-甲基-17-氧代-7,8,9,11,12,14,15,16-八氢-6H-环戊二烯并[a]菲-3-基]氧基]四氢吡喃-2-羧酸
• 英文名: (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[[(8S,9S,13S,14S)-2-Methoxy-13-Methyl-17-Oxo-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[a]Phenanthren-3-Yl]Oxy]Oxane-2-Carboxylic Acid
• 别名: (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[[(8R,9S,13S,14S)-2-Methoxy-13-Methyl-17-Oxo-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[A]Phenanthren-3-Yl]Oxy]Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[[(8R,9S,13S,14S)-2-Methoxy-13-Methyl-17-Oxo-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[A]Phenanthren-3-Yl]Oxy]-2-Tetrahydropyrancarboxylic Acid; (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[[(8R,9S,13S,14S)-17-Keto-2-Methoxy-13-Methyl-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[A]Phenanthren-3-Yl]Oxy]Tetrahydropyran-2-Carboxylic Acid
• 分子式: C₂₅H₃₂O₉
• 分子量: 476.52
• CAS 登录号: 25577-70-2
• 分子行输入简码 SMILES: [C@@]15(C)[C@H]([C@H]4[C@H](CC1)C3=CC(=C(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)C=C3CC4)OC)CCC5=O
• 国际化学标识码 InChI: 1S/C25H32O9/c1-25-8-7-12-13(15(25)5-6-18(25)26)4-3-11-9-17(16(32-2)10-14(11)12)33-24-21(29)19(27)20(28)22(34-24)23(30)31/h9-10,12-13,15,19-22,24,27-29H,3-8H2,1-2H3,(H,30,31)/t12-,13+,15-,19-,20-,21+,22-,24+,25-/m0/s1
• 国际化学标识检索码 InChIKey: NZTHZDNDYACBSX-FJNWEKAQSA-N

物理化学性质

• 密度: 1.408g/cm³ （计算值）
• 沸点: 710.765°C at 760 mmHg （计算值）
• 闪点: 241.463°C （计算值）