(7S,9S)-6,9,11-三羟基-9-(2-羟基乙酰基)-7-[(2R,4S,6R)-4-羟基-6-甲基四氢吡喃-2-基]氧基-4-甲氧基-8,10-二氢-7H-并四苯-5,12-二酮
[CAS# 130592-19-7]

基本信息

• 产品名称: (7S,9S)-6,9,11-三羟基-9-(2-羟基乙酰基)-7-[(2R,4S,6R)-4-羟基-6-甲基四氢吡喃-2-基]氧基-4-甲氧基-8,10-二氢-7H-并四苯-5,12-二酮
• 英文名: (7S,9S)-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-7-[(2R,4S,6R)-4-Hydroxy-6-Methyloxan-2-Yl]Oxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
• 别名: (7S,9S)-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-7-[(2R,4S,6R)-4-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (7S,9S)-6,9,11-Trihydroxy-7-[[(2R,4S,6R)-4-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-9-(2-Hydroxy-1-Oxoethyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (7S,9S)-9-Glycoloyl-6,9,11-Trihydroxy-7-[(2R,4S,6R)-4-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• 分子式: C₂₇H₂₈O₁₁
• 分子量: 528.51
• CAS 登录号: 130592-19-7
• 分子行输入简码 SMILES: [C@@H]3(O[C@H]1O[C@@H](C[C@H](O)C1)C)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/C27H28O11/c1-11-6-12(29)7-18(37-11)38-16-9-27(35,17(30)10-28)8-14-20(16)26(34)22-21(24(14)32)23(31)13-4-3-5-15(36-2)19(13)25(22)33/h3-5,11-12,16,18,28-29,32,34-35H,6-10H2,1-2H3/t11-,12+,16+,18-,27+/m1/s1
• 国际化学标识检索码 InChIKey: TZBDURDLNXOXBK-HWDYCMBPSA-N

物理化学性质

• 密度: 1.589g/cm³ （计算值）
• 沸点: 794.583°C at 760 mmHg （计算值）
• 闪点: 267.429°C （计算值）