依勒霉素
[CAS# 75634-51-4]

基本信息

• 产品名称: 依勒霉素
• 英文名: Iremycin
• 别名: (9R,10R)-10-[(2S,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-9-Ethyl-4,6,9,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (9R,10R)-10-[[(2S,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-9-Ethyl-4,6,9,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (9R,10R)-10-[(2S,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-9-Ethyl-4,6,9,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• 分子式: C₂₈H₃₃NO₉
• 分子量: 527.57
• CAS 登录号: 75634-51-4
• 分子行输入简码 SMILES: [C@H]4(C3=C(C1=C(C(=O)C2=C(C1=O)C=CC=C2O)C(=C3CC[C@]4(O)CC)O)O)O[C@H]5C[C@H](N(C)C)[C@@H]([C@@H](O5)C)O
• 国际化学标识码 InChI: 1S/C28H33NO9/c1-5-28(36)10-9-14-19(27(28)38-17-11-15(29(3)4)22(31)12(2)37-17)26(35)21-20(24(14)33)25(34)18-13(23(21)32)7-6-8-16(18)30/h6-8,12,15,17,22,27,30-31,33,35-36H,5,9-11H2,1-4H3/t12-,15-,17-,22+,27+,28+/m0/s1
• 国际化学标识检索码 InChIKey: HECQIFUUJRYFRO-VMINLZLMSA-N

物理化学性质

• 密度: 1.495g/cm³ （计算值）
• 沸点: 709.682°C at 760 mmHg （计算值）
• 闪点: 383.002°C （计算值）