[(2R,3R,4S,5R,6R)-4,5-二羟基-2-[(1R,2S)-2-羟基环己基]氧基-6-(羟基甲基)四氢吡喃-3-基]3-(4-羟基苯基)丙-2-烯酸酯
[CAS# 15732-48-6]

基本信息

• 产品名称: [(2R,3R,4S,5R,6R)-4,5-二羟基-2-[(1R,2S)-2-羟基环己基]氧基-6-(羟基甲基)四氢吡喃-3-基]3-(4-羟基苯基)丙-2-烯酸酯
• 英文名: [(2R,3R,4S,5R,6R)-4,5-Dihydroxy-2-[(1R,2S)-2-Hydroxycyclohexyl]Oxy-6-(Hydroxymethyl)Oxan-3-Yl] 3-(4-Hydroxyphenyl)Prop-2-Enoate
• 别名: [(2R,3R,4S,5S,6R)-4,5-Dihydroxy-2-[(1R,2S)-2-Hydroxycyclohexoxy]-6-(Hydroxymethyl)Tetrahydropyran-3-Yl] (E)-3-(4-Hydroxyphenyl)Prop-2-Enoate; (E)-3-(4-Hydroxyphenyl)Prop-2-Enoic Acid [(2R,3R,4S,5S,6R)-4,5-Dihydroxy-2-[(1R,2S)-2-Hydroxycyclohexoxy]-6-(Hydroxymethyl)-3-Tetrahydropyranyl] Ester; (E)-3-(4-Hydroxyphenyl)Acrylic Acid [(2R,3R,4S,5S,6R)-4,5-Dihydroxy-2-[(1R,2S)-2-Hydroxycyclohexoxy]-6-Methylol-Tetrahydropyran-3-Yl] Ester
• 分子式: C₂₁H₂₈O₉
• 分子量: 424.45
• CAS 登录号: 15732-48-6
• 分子行输入简码 SMILES: [C@@H]1([C@@H](O[C@@H]([C@H]([C@@H]1O)O)CO)O[C@H]2[C@@H](O)CCCC2)OC(/C=C/C3=CC=C(C=C3)O)=O
• 国际化学标识码 InChI: 1S/C21H28O9/c22-11-16-18(26)19(27)20(21(29-16)28-15-4-2-1-3-14(15)24)30-17(25)10-7-12-5-8-13(23)9-6-12/h5-10,14-16,18-24,26-27H,1-4,11H2/b10-7+/t14-,15+,16+,18+,19-,20+,21+/m0/s1
• 国际化学标识检索码 InChIKey: ZTMPDTJBTNGZJH-QMZLQNRASA-N

物理化学性质

• 密度: 1.43g/cm³ （计算值）
• 沸点: 671.003°C at 760 mmHg （计算值）
• 闪点: 233.648°C （计算值）