2-[3-[[2-[[2-[[2-[[2-[[2-[[3-Hydroxy-2-[[6-hydroxy-4-methyl-2-[[4-methyl-1-(4-methylhex-2-enoyl)pyrrolidine-2-carbonyl]amino]-8-oxodecanoyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]propanoylamino]propanoic acid

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 肽模拟物
• 英文名称: 2-[3-[[2-[[2-[[2-[[2-[[2-[[3-Hydroxy-2-[[6-hydroxy-4-methyl-2-[[4-methyl-1-(4-methylhex-2-enoyl)pyrrolidine-2-carbonyl]amino]-8-oxodecanoyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]propanoylamino]propanoic acid
• 英文别名: 2-[3-[[2-[[2-[[2-[[2-[[2-[[3-hydroxy-2-[[6-hydroxy-4-methyl-2-[[4-methyl-1-(4-methylhex-2-enoyl)pyrrolidine-2-carbonyl]amino]-8-oxodecanoyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]propanoylamino]propanoic acid
• 化学式: C₆₀H₁₀₄N₁₀O₁₅
• 分子量: 1205.5
• InChiKey: RNNIWZPLXMQCIS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  85
• 可旋转键数：
  36
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.77
• 拓扑面积：
  377
• 氢给体数：
  12
• 氢受体数：
  15