3-[[4-[[3-[[1-(3-Aminobutanoylamino)-5-(diaminomethylideneamino)-1-hydroxypentan-2-yl]amino]-2-methyl-3-oxopropanoyl]amino]-7-(diaminomethylideneamino)-3-hydroxyheptanoyl]oxymethyl]-7-[(5-amino-5-carboxypentanoyl)amino]-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 3-[[4-[[3-[[1-(3-Aminobutanoylamino)-5-(diaminomethylideneamino)-1-hydroxypentan-2-yl]amino]-2-methyl-3-oxopropanoyl]amino]-7-(diaminomethylideneamino)-3-hydroxyheptanoyl]oxymethyl]-7-[(5-amino-5-carboxypentanoyl)amino]-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
• 英文别名: 3-[[4-[[3-[[1-(3-aminobutanoylamino)-5-(diaminomethylideneamino)-1-hydroxypentan-2-yl]amino]-2-methyl-3-oxopropanoyl]amino]-7-(diaminomethylideneamino)-3-hydroxyheptanoyl]oxymethyl]-7-[(5-amino-5-carboxypentanoyl)amino]-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
• 化学式: C₃₇H₆₂N₁₄O₁₄S
• 分子量: 959.0
• InChiKey: MTVGIGSEWSHDKC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -10.9
• 重原子数：
  66
• 可旋转键数：
  30
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  513
• 氢给体数：
  15
• 氢受体数：
  19