2-[2-[[2-[[2-[2-[[6-amino-2-[[2-[[6-amino-2-[[2-[[2-[2-[[5-amino-2-[[2-[[2-[[2-[[2-[[2-[2-[[2-[(2-aminoacetyl)amino]-3-methylpentanoyl]amino]propanoylamino]acetyl]amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoyl]amino]propanoylamino]-3-hydroxypropanoyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]-3-phenylpropanoyl]amino]hexanoyl]amino]hexanoylamino]-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]propanoylamino]pentanedioic 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-[[2-[[2-[2-[[6-amino-2-[[2-[[6-amino-2-[[2-[[2-[2-[[5-amino-2-[[2-[[2-[[2-[[2-[[2-[2-[[2-[(2-aminoacetyl)amino]-3-methylpentanoyl]amino]propanoylamino]acetyl]amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoyl]amino]propanoylamino]-3-hydroxypropanoyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]-3-phenylpropanoyl]amino]hexanoyl]amino]hexanoylamino]-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]propanoylamino]pentanedioic acid
• 化学式: C₁₀₂H₁₅₂N₂₆O₂₉
• 分子量: 2206.5
• InChiKey: RHCBDLHUKITYRJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -9.5
• 重原子数：
  157
• 可旋转键数：
  73
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  891
• 氢给体数：
  31
• 氢受体数：
  33