(2S,3S,4S,5R,6S)-3,4,5-三羟基-6-[3-羟基-2-[(1R,6S)-3-甲基-6-丙-1-烯-2-基-1-环己-2-烯基]-5-戊基-苯氧基]四氢吡喃-2-羧酸
[CAS# 68170-65-0]

基本信息

• 产品名称: (2S,3S,4S,5R,6S)-3,4,5-三羟基-6-[3-羟基-2-[(1R,6S)-3-甲基-6-丙-1-烯-2-基-1-环己-2-烯基]-5-戊基-苯氧基]四氢吡喃-2-羧酸
• 英文名: (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[3-Hydroxy-2-[(1R,6S)-3-Methyl-6-Prop-1-En-2-Yl-1-Cyclohex-2-Enyl]-5-Pentyl-Phenoxy]Oxane-2-Carboxylic Acid
• 别名: (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[3-Hydroxy-2-[(1S,6S)-6-Isopropenyl-3-Methyl-1-Cyclohex-2-Enyl]-5-Pentyl-Phenoxy]Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[3-Hydroxy-2-[(1S,6S)-6-Isopropenyl-3-Methyl-1-Cyclohex-2-Enyl]-5-Pentylphenoxy]-2-Tetrahydropyrancarboxylic Acid; (2S,3S,4S,5R,6S)-6-[5-Amyl-3-Hydroxy-2-[(1S,6S)-6-Isopropenyl-3-Methyl-1-Cyclohex-2-Enyl]Phenoxy]-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid
• 分子式: C₂₇H₃₈O₈
• 分子量: 490.59
• CAS 登录号: 68170-65-0
• 分子行输入简码 SMILES: [C@@H]3(C1=C(O)C=C(C=C1O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)CCCCC)[C@@H](C(=C)C)CCC(=C3)C
• 国际化学标识码 InChI: 1S/C27H38O8/c1-5-6-7-8-16-12-19(28)21(18-11-15(4)9-10-17(18)14(2)3)20(13-16)34-27-24(31)22(29)23(30)25(35-27)26(32)33/h11-13,17-18,22-25,27-31H,2,5-10H2,1,3-4H3,(H,32,33)/t17-,18+,22+,23+,24-,25+,27-/m1/s1
• 国际化学标识检索码 InChIKey: DTPDUSBNMCFKKQ-OVFIKLTOSA-N

物理化学性质

• 密度: 1.261g/cm³ （计算值）
• 沸点: 661.526°C at 760 mmHg （计算值）
• 闪点: 215.327°C （计算值）