神经胺乳糖醇
[CAS# 65907-88-2]

基本信息

• 产品名称: 神经胺乳糖醇
• 英文名: Neuramin Lactitol
• 别名: (2S,4S,5R,6R)-5-Acetamido-2-[(2S,3R,5S,6R)-2-[(1R,2R,3S)-1-[(1R)-1,2-Dihydroxyethyl]-2,3,4-Trihydroxy-Butoxy]-3,5-Dihydroxy-6-(Hydroxymethyl)Tetrahydropyran-4-Yl]Oxy-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]Tetrahydropyran-2-Carboxylic Acid; (2S,4S,5R,6R)-5-Acetamido-2-[[(2S,3R,5S,6R)-2-[(1R,2R,3S)-1-[(1R)-1,2-Dihydroxyethyl]-2,3,4-Trihydroxybutoxy]-3,5-Dihydroxy-6-(Hydroxymethyl)-4-Tetrahydropyranyl]Oxy]-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]-2-Tetrahydropyrancarboxylic Acid; (2S,4S,5R,6R)-5-Acetamido-2-[(2S,3R,5S,6R)-2-[(1R,2R,3S)-1-[(1R)-1,2-Dihydroxyethyl]-2,3,4-Trihydroxy-Butoxy]-3,5-Dihydroxy-6-Methylol-Tetrahydropyran-4-Yl]Oxy-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]Tetrahydropyran-2-Carboxylic Acid
• 分子式: C₂₃H₄₁NO₁₉
• 分子量: 635.57
• CAS 登录号: 65907-88-2
• 分子行输入简码 SMILES: [C@H](O)([C@H](O[C@@H]1O[C@@H]([C@@H](C([C@H]1O)O[C@]2(O[C@H]([C@@H]([C@H](C2)O)NC(C)=O)[C@@H]([C@@H](CO)O)O)C(=O)O)O)CO)[C@@H](CO)O)[C@H](CO)O
• 国际化学标识码 InChI: 1S/C23H41NO19/c1-7(29)24-13-8(30)2-23(22(38)39,42-19(13)15(35)10(32)4-26)43-20-16(36)12(6-28)40-21(17(20)37)41-18(11(33)5-27)14(34)9(31)3-25/h8-21,25-28,30-37H,2-6H2,1H3,(H,24,29)(H,38,39)/t8-,9-,10+,11+,12+,13+,14+,15+,16-,17+,18+,19+,20?,21-,23-/m0/s1
• 国际化学标识检索码 InChIKey: HTAGRCVASQXJKI-UZZLLYHASA-N

物理化学性质

• 密度: 1.732g/cm³ （计算值）
• 沸点: 1143.021°C at 760 mmHg （计算值）
• 闪点: 645.076°C （计算值）