(3R,5R)-7-[(1S,2R,3S,8S,8aR)-3-羟基-2-甲基-8-[(2S)-2-甲基丁酰基]氧基-1,2,3,7,8,8a-六氢萘-1-基]-3,5-二羟基-庚酸
[CAS# 81131-74-0]

基本信息

• 产品名称: (3R,5R)-7-[(1S,2R,3S,8S,8aR)-3-羟基-2-甲基-8-[(2S)-2-甲基丁酰基]氧基-1,2,3,7,8,8a-六氢萘-1-基]-3,5-二羟基-庚酸
• 英文名: (3R,5R)-7-[(1S,2R,3S,8S,8aR)-3-Hydroxy-2-Methyl-8-[(2S)-2-Methylbutanoyl]Oxy-1,2,3,7,8,8a-Hexahydronaphthalen-1-Yl]-3,5-Dihydroxy-Heptanoic Acid
• 别名: (3R,5R)-7-[(1S,2R,3S,8S,8Ar)-3-Hydroxy-2-Methyl-8-[(2S)-2-Methylbutanoyl]Oxy-1,2,3,7,8,8A-Hexahydronaphthalen-1-Yl]-3,5-Dihydroxy-Heptanoic Acid; (3R,5R)-7-[(1S,2R,3S,8S,8Ar)-3-Hydroxy-2-Methyl-8-[(2S)-2-Methyl-1-Oxobutoxy]-1,2,3,7,8,8A-Hexahydronaphthalen-1-Yl]-3,5-Dihydroxyheptanoic Acid; (3R,5R)-7-[(1S,2R,3S,8S,8Ar)-3-Hydroxy-2-Methyl-8-[(2S)-2-Methylbutanoyl]Oxy-1,2,3,7,8,8A-Hexahydronaphthalen-1-Yl]-3,5-Dihydroxy-Enanthic Acid
• 分子式: C₂₃H₃₆O₇
• 分子量: 424.53
• CAS 登录号: 81131-74-0
• 分子行输入简码 SMILES: [C@@H]12[C@H]([C@H]([C@H](O)C=C1C=CC[C@@H]2OC(=O)[C@H](CC)C)C)CC[C@@H](O)C[C@@H](O)CC(=O)O
• 国际化学标识码 InChI: 1S/C23H36O7/c1-4-13(2)23(29)30-20-7-5-6-15-10-19(26)14(3)18(22(15)20)9-8-16(24)11-17(25)12-21(27)28/h5-6,10,13-14,16-20,22,24-26H,4,7-9,11-12H2,1-3H3,(H,27,28)/t13-,14+,16+,17+,18-,19+,20-,22-/m0/s1
• 国际化学标识检索码 InChIKey: HIZIJHNJVQOXLO-YMUQFYNDSA-N

物理化学性质

• 密度: 1.216g/cm³ （计算值）
• 沸点: 640.296°C at 760 mmHg （计算值）
• 闪点: 215.488°C （计算值）