3-[15-[[2-[[2-[[2-[[2-[[2-[[6-Amino-2-[[2-[[5-[(4-amino-4-oxobutanoyl)amino]-8-hydroxy-9-oxo-1,2,3,4-tetrahydropyrimido[1,2-a]quinoline-1-carbonyl]amino]-3-hydroxypropanoyl]amino]hexanoyl]amino]acetyl]amino]-5-[formyl(hydroxy)amino]pentanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-2-[3-[formyl(hydroxy)amino]propyl]-8-(hydroxymethyl)-3,6,9,16-tetraoxo-1,4,7,10-tetrazacyclohexadec-5-yl]propanoic 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-[15-[[2-[[2-[[2-[[2-[[2-[[6-Amino-2-[[2-[[5-[(4-amino-4-oxobutanoyl)amino]-8-hydroxy-9-oxo-1,2,3,4-tetrahydropyrimido[1,2-a]quinoline-1-carbonyl]amino]-3-hydroxypropanoyl]amino]hexanoyl]amino]acetyl]amino]-5-[formyl(hydroxy)amino]pentanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-2-[3-[formyl(hydroxy)amino]propyl]-8-(hydroxymethyl)-3,6,9,16-tetraoxo-1,4,7,10-tetrazacyclohexadec-5-yl]propanoic acid
• 英文别名: 3-[15-[[2-[[2-[[2-[[2-[[2-[[6-amino-2-[[2-[[5-[(4-amino-4-oxobutanoyl)amino]-8-hydroxy-9-oxo-1,2,3,4-tetrahydropyrimido[1,2-a]quinoline-1-carbonyl]amino]-3-hydroxypropanoyl]amino]hexanoyl]amino]acetyl]amino]-5-[formyl(hydroxy)amino]pentanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-2-[3-[formyl(hydroxy)amino]propyl]-8-(hydroxymethyl)-3,6,9,16-tetraoxo-1,4,7,10-tetrazacyclohexadec-5-yl]propanoic acid
• 化学式: C₆₂H₉₃N₁₉O₂₆
• 分子量: 1520.5
• InChiKey: UKBWLMIBBBZLKT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -12.7
• 重原子数：
  107
• 可旋转键数：
  39
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  699
• 氢给体数：
  24
• 氢受体数：
  29