(7R,9S)-7-[(2R,3R,4S,5R)-3,4-二羟基-5-(羟基甲基)四氢呋喃-2-基]氧基-6,9,11-三羟基-9-(2-羟基乙酰基)-4-甲氧基-8,10-二氢-7H-并四苯-5,12-二酮
[CAS# 105444-10-8]

基本信息

• 产品名称: (7R,9S)-7-[(2R,3R,4S,5R)-3,4-二羟基-5-(羟基甲基)四氢呋喃-2-基]氧基-6,9,11-三羟基-9-(2-羟基乙酰基)-4-甲氧基-8,10-二氢-7H-并四苯-5,12-二酮
• 英文名: (7R,9S)-7-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]Oxy-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
• 别名: (7R,9S)-7-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]Oxy-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (7R,9S)-7-[[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]Oxy]-6,9,11-Trihydroxy-9-(2-Hydroxy-1-Oxoethyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (7R,9S)-7-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-Methylol-Tetrahydrofuran-2-Yl]Oxy-9-Glycoloyl-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• 分子式: C₂₆H₂₆O₁₃
• 分子量: 546.48
• CAS 登录号: 105444-10-8
• 分子行输入简码 SMILES: [C@H]3(O[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)CO)C2=C(O)C5=C(C(=C2C[C@](O)(C3)C(=O)CO)O)C(=O)C4=CC=CC(=C4C5=O)OC
• 国际化学标识码 InChI: 1S/C26H26O13/c1-37-11-4-2-3-9-15(11)22(33)18-17(19(9)30)20(31)10-5-26(36,14(29)8-28)6-12(16(10)23(18)34)38-25-24(35)21(32)13(7-27)39-25/h2-4,12-13,21,24-25,27-28,31-32,34-36H,5-8H2,1H3/t12-,13-,21-,24-,25-,26+/m1/s1
• 国际化学标识检索码 InChIKey: WAIUUSMYFGCHDB-WVHWHMGYSA-N

物理化学性质

• 密度: 1.754g/cm³ （计算值）
• 沸点: 869.05°C at 760 mmHg （计算值）
• 闪点: 293.905°C （计算值）