K-毒毛花苷-beta
[CAS# 560-53-2]

基本信息

• 产品名称: K-毒毛花苷-beta
• 英文名: K-Strophanthin-beta
• 别名: 5,14-Dihydroxy-3-[4-Methoxy-6-Methyl-5-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxy-13-Methyl-17-(5-Oxo-2H-Furan-3-Yl)-2,3,4,6,7,8,9,11,12,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthrene-10-Carbaldehyde; 5,14-Dihydroxy-3-[[4-Methoxy-6-Methyl-5-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-2-Tetrahydropyranyl]Oxy]-13-Methyl-17-(5-Oxo-2H-Furan-3-Yl)-2,3,4,6,7,8,9,11,12,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthrene-10-Carboxaldehyde; 5,14-Dihydroxy-17-(5-Keto-2H-Furan-3-Yl)-3-[4-Methoxy-6-Methyl-5-(3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxy-13-Methyl-2,3,4,6,7,8,9,11,12,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthrene-10-Carbaldehyde
• 分子式: C₃₆H₅₄O₁₄
• 分子量: 710.81
• CAS 登录号: 560-53-2
• EINECS 登录号: 209-210-9
• 分子行输入简码 SMILES: C(C7OC(OC6C(CC(OC5CC4(C(C3C(C2(C(C(C1=CC(=O)OC1)CC2)(C)CC3)O)CC4)(CC5)C=O)O)OC6C)OC)C(C(O)C7O)O)O
• 国际化学标识码 InChI: 1S/C36H54O14/c1-18-31(50-32-30(42)29(41)28(40)25(15-37)49-32)24(45-3)13-27(47-18)48-20-4-9-34(17-38)22-5-8-33(2)21(19-12-26(39)46-16-19)7-11-36(33,44)23(22)6-10-35(34,43)14-20/h12,17-18,20-25,27-32,37,40-44H,4-11,13-16H2,1-3H3
• 国际化学标识检索码 InChIKey: FHIREUBIEIPPMC-UHFFFAOYSA-N

物理化学性质

• 密度: 1.423g/cm³ （计算值）
• 沸点: 877.07°C at 760 mmHg （计算值）
• 闪点: 270.106°C （计算值）