硫霉菌素
[CAS# 83753-74-6]

基本信息

• 产品名称: 硫霉菌素
• 英文名: Sulfurmycin
• 别名: Methyl (1R,2S,4S)-2-Acetonyl-4-[(2R,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-2,5,7-Trihydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracene-1-Carboxylate; (1R,2S,4S)-2-Acetonyl-4-[[(2R,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-2,5,7-Trihydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracene-1-Carboxylic Acid Methyl Ester; (1R,2S,4S)-2-Acetonyl-4-[(2R,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-2,5,7-Trihydroxy-6,11-Diketo-3,4-Dihydro-1H-Tetracene-1-Carboxylic Acid Methyl Ester
• 分子式: C₃₁H₃₅NO₁₁
• 分子量: 597.62
• CAS 登录号: 83753-74-6
• 分子行输入简码 SMILES: [C@H]3(C1=CC5=C(C(=C1[C@@H](O[C@@H]2O[C@H]([C@@H](O)[C@@H](N(C)C)C2)C)C[C@]3(O)CC(=O)C)O)C(=O)C4=C(O)C=CC=C4C5=O)C(OC)=O
• 国际化学标识码 InChI: 1S/C31H35NO11/c1-13(33)11-31(40)12-20(43-21-10-18(32(3)4)26(35)14(2)42-21)23-16(25(31)30(39)41-5)9-17-24(29(23)38)28(37)22-15(27(17)36)7-6-8-19(22)34/h6-9,14,18,20-21,25-26,34-35,38,40H,10-12H2,1-5H3/t14-,18-,20-,21-,25-,26+,31+/m0/s1
• 国际化学标识检索码 InChIKey: YPHXBUMJGHZUMJ-UCPUWLPESA-N

物理化学性质

• 密度: 1.478g/cm³ （计算值）
• 沸点: 755.067°C at 760 mmHg （计算值）
• 闪点: 410.45°C （计算值）