2-[[2-[[4-amino-2-[[2-[[2-[[2-[[2-[2-[[6-amino-2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-4-hydroxy-4-oxo-butanoyl]amino]hexanoyl]amino]propanoylamino]-3-hydroxy-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-3-hydroxy-butanoyl]amino]-4-oxo-butanoyl]amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-4-methyl-pentanoic acid

• 分子结构分类: 有机化合物 - 有机聚合物 - 多肽
• 英文名称: 2-[[2-[[4-amino-2-[[2-[[2-[[2-[[2-[2-[[6-amino-2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-4-hydroxy-4-oxo-butanoyl]amino]hexanoyl]amino]propanoylamino]-3-hydroxy-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-3-hydroxy-butanoyl]amino]-4-oxo-butanoyl]amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-4-methyl-pentanoic acid
• 英文别名: 2-[[2-[[4-amino-2-[[2-[[2-[[2-[[2-[2-[[6-amino-2-[[2-[(2-amino-4-methylpentanoyl)amino]-3-carboxypropanoyl]amino]hexanoyl]amino]propanoylamino]-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoic acid
• 化学式: C₅₄H₈₅N₁₅O₁₉
• 分子量: 1248.3
• InChiKey: MHGHWEVIFOADRN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -9.5
• 重原子数：
  88
• 可旋转键数：
  40
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  570
• 氢给体数：
  20
• 氢受体数：
  22