三铁阿霉素
[CAS# 64719-39-7]

基本信息

• 产品名称: 三铁阿霉素
• 英文名: Quelamycin
• 别名: Ferric (7S,9S)-7-[(2S,4R,5R,6R)-4-Amino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; Ferric (7S,9S)-7-[[(2S,4R,5R,6R)-4-Amino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-6,9,11-Trihydroxy-9-(2-Hydroxy-1-Oxoethyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; Ferric (7S,9S)-7-[(2S,4R,5R,6R)-4-Amino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-9-Glycoloyl-6,9,11-Trihydroxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• 分子式: C₂₇H₂₉FeNO₁₁
• 分子量: 599.37
• CAS 登录号: 64719-39-7
• 分子行输入简码 SMILES: [C@@]3(O)(CC1=C(O)C4=C(C(=C1[C@@H](O[C@H]2O[C@@H]([C@H](O)[C@H](N)C2)C)C3)O)C(=O)C5=C(C4=O)C=CC=C5OC)C(=O)CO.[Fe+3]
• 国际化学标识码 InChI: 1S/C27H29NO11.Fe/c1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34;/h3-5,10,13,15,17,22,29,31,33,35-36H,6-9,28H2,1-2H3;/q;+3/t10-,13-,15+,17-,22+,27+;/m1./s1
• 国际化学标识检索码 InChIKey: AESVUZLWRXEGEX-GJPCMZTKSA-N

物理化学性质

• 沸点: 810.3°C at 760 mmHg （计算值）
• 闪点: 443.8°C （计算值）