4-(羟基甲基)-6-[[2,3,4-三羟基-5-(羟基甲基)环己基]氨基]环己-4-烯-1,2,3-三醇
[CAS# 38665-10-0]

基本信息

• 产品名称: 4-(羟基甲基)-6-[[2,3,4-三羟基-5-(羟基甲基)环己基]氨基]环己-4-烯-1,2,3-三醇
• 英文名: 4-(Hydroxymethyl)-6-[[2,3,4-Trihydroxy-5-(Hydroxymethyl)Cyclohexyl]Amino]Cyclohex-4-Ene-1,2,3-Triol
• 别名: 4-Methylol-6-[(2,3,4-Trihydroxy-5-Methylol-Cyclohexyl)Amino]Cyclohex-4-Ene-1,2,3-Triol; D-Chiro-Inositol, 1,5,6-Trideoxy-5-(Hydroxymethyl)-1-((4,5,6-Trihydroxy-3-(Hydroxymethyl)-2-Cyclohexen-1-Yl)Amino)-, (1S-(1Alpha,4Alpha,5Beta,6Alpha))-; D-Chiro-Inositol, 5-(Hydroxymethyl)-1,5,6-Trideoxy-1-((4,5,6-Trihydroxy-3-(Hydroxymethyl)-2-Cyclohexen-1-Yl)Amino)-, (1S-(1-Alpha,4-Alpha,5-Beta,6-Alpha))-
• 分子式: C₁₄H₂₅NO₈
• 分子量: 335.35
• CAS 登录号: 38665-10-0
• 分子行输入简码 SMILES: C(O)C2=CC(NC1C(O)C(O)C(O)C(C1)CO)C(O)C(O)C2O
• 国际化学标识码 InChI: 1S/C14H25NO8/c16-3-5-1-7(11(20)13(22)9(5)18)15-8-2-6(4-17)10(19)14(23)12(8)21/h1,6-23H,2-4H2
• 国际化学标识检索码 InChIKey: YCJYNBLLJHFIIW-UHFFFAOYSA-N

物理化学性质

• 密度: 1.613g/cm³ （计算值）
• 沸点: 602.576°C at 760 mmHg （计算值）
• 闪点: 222.565°C （计算值）

参考文献

• (1): F. Cardona, A. Goti, C. Parmeggiani, P. Parenti, M. Forcella, P. Fusi, L. Cipolla, S. M. Roberts, G. J. Davies and T. M. Gloster. Casuarine-6-O-α-d-glucoside and its analogues are tight binding inhibitors of insect and bacterial trehalases, Chem. Commun., 2010