3-[2-[3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoylamino]ethylsulfanyl]-7-oxo-6-(1-sulfooxyethyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

• 常用名: 3-[2-[3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoylamino]ethylsulfanyl]-7-oxo-6-(1-sulfooxyethyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
• 英文名: 3-[2-[3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoylamino]ethylsulfanyl]-7-oxo-6-(1-sulfooxyethyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
• CAS号: 82475-09-0
• 分子量: 553.60400
• 密度: 1.56g/cm3
• 沸点: N/A
• 分子式: C₂₀H₃₁N₃O₁₁S₂
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: 3-[2-[3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoylamino]ethylsulfanyl]-7-oxo-6-(1-sulfooxyethyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

物理化学性质

• 密度: 1.56g/cm3
• 分子式: C₂₀H₃₁N₃O₁₁S₂
• 分子量: 553.60400
• 精确质量: 553.14000
• PSA: 260.53000
• LogP: 1.15560
• InChIKey: GRWWKENHBQJAML-UHFFFAOYSA-N
• SMILES: CC(OS(=O)(=O)O)C1C(=O)N2C(C(=O)O)=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)CO)CC12
• 折射率: 1.635

英文别名

• 1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid,3-((2-((3-((2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)amino)-1-oxopropyl)amino)ethyl)thio)-7-oxo-6-(1-(sulfooxy)ethyl)
• Antibiotic OA 6129C
• OA-6129C
• 3-[(2-{[n-(2,4-dihydroxy-3,3-dimethylbutanoyl)-|A-alanyl]amino}ethyl)sulfanyl]-7-oxo-6-[1-(sulfooxy)ethyl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid