库霉素
[CAS# 11005-94-0]

基本信息

• 产品名称: 库霉素
• 英文名: Cranomycin
• 别名: [(1S,2R,3S,4S,5S)-5-[(3-Acetylphenyl)Amino]-4-Amino-3-(Dimethylcarbamoylamino)-3-Ethyl-1,2-Dihydroxy-2-Methyl-Cyclopentyl]Methyl 2-Hydroxy-6-Methyl-Benzoate; 2-Hydroxy-6-Methylbenzoic Acid [(1S,2R,3S,4S,5S)-5-[(3-Acetylphenyl)Amino]-4-Amino-3-[(Dimethylamino-Oxomethyl)Amino]-3-Ethyl-1,2-Dihydroxy-2-Methylcyclopentyl]Methyl Ester; 2-Hydroxy-6-Methyl-Benzoic Acid [(1S,2R,3S,4S,5S)-5-[(3-Acetylphenyl)Amino]-4-Amino-3-(Dimethylcarbamoylamino)-3-Ethyl-1,2-Dihydroxy-2-Methyl-Cyclopentyl]Methyl Ester
• 分子式: C₂₈H₃₈N₄O₇
• 分子量: 542.63
• CAS 登录号: 11005-94-0 (104820-96-4)
• 分子行输入简码 SMILES: [C@@]2([C@]([C@](COC(C1=C(O)C=CC=C1C)=O)(O)[C@H]([C@@H]2N)NC3=CC(=CC=C3)C(=O)C)(O)C)(NC(N(C)C)=O)CC
• 国际化学标识码 InChI: 1S/C28H38N4O7/c1-7-27(31-25(36)32(5)6)22(29)23(30-19-12-9-11-18(14-19)17(3)33)28(38,26(27,4)37)15-39-24(35)21-16(2)10-8-13-20(21)34/h8-14,22-23,30,34,37-38H,7,15,29H2,1-6H3,(H,31,36)/t22-,23-,26+,27-,28+/m0/s1
• 国际化学标识检索码 InChIKey: ZDHIGMAZJWYGPX-YONDKBSQSA-N

物理化学性质

• 密度: 1.337g/cm³ （计算值）
• 沸点: 749.112°C at 760 mmHg （计算值）
• 闪点: 406.849°C （计算值）