鼠李糖基-鼠李糖基-3-脱氧甘露辛柄糖酸
[CAS# 111070-81-6]

基本信息

• 产品名称: 鼠李糖基-鼠李糖基-3-脱氧甘露辛柄糖酸
• 英文名: Rhamnosyl-rhamnosyl-3-deoxymannooctulosonic acid
• 别名: (4R,5R,6R,7R)-8-[(2R,3R,4R,5S,6S)-3,5-Dihydroxy-6-Methyl-4-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxy-4,5,6,7-Tetrahydroxy-2-Oxo-Octanoic Acid; (4R,5R,6R,7R)-8-[[(2R,3R,4R,5S,6S)-3,5-Dihydroxy-6-Methyl-4-[[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-2-Tetrahydropyranyl]Oxy]-4,5,6,7-Tetrahydroxy-2-Oxooctanoic Acid; (4R,5R,6R,7R)-8-[(2R,3R,4R,5S,6S)-3,5-Dihydroxy-6-Methyl-4-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxy-4,5,6,7-Tetrahydroxy-2-Keto-Caprylic Acid
• 分子式: C₂₀H₃₄O₁₆
• 分子量: 530.48
• CAS 登录号: 111070-81-6
• 分子行输入简码 SMILES: [C@H]1(O[C@H]([C@@H]([C@@H]([C@H]1O)O[C@@H]2O[C@H]([C@@H]([C@H]([C@H]2O)O)O)C)O)OC[C@H]([C@H]([C@@H]([C@@H](CC(C(=O)O)=O)O)O)O)O)C
• 国际化学标识码 InChI: 1S/C20H34O16/c1-5-10(24)14(28)15(29)20(35-5)36-17-11(25)6(2)34-19(16(17)30)33-4-9(23)13(27)12(26)7(21)3-8(22)18(31)32/h5-7,9-17,19-21,23-30H,3-4H2,1-2H3,(H,31,32)/t5-,6-,7+,9+,10-,11-,12+,13+,14+,15+,16+,17+,19+,20-/m0/s1
• 国际化学标识检索码 InChIKey: HARGVJONLXPVEX-PILVOEBPSA-N

物理化学性质

• 密度: 1.661g/cm³ （计算值）
• 沸点: 901.024°C at 760 mmHg （计算值）
• 闪点: 305.64°C （计算值）