[1-[12-(3-Amino-3-oxopropyl)-37-butan-2-yl-31-ethylidene-15-hydroxy-28-(1-hydroxyethyl)-34-(hydroxymethyl)-2,8,11,14,18,24,27,30,33,36,39-undecaoxo-25-(2-phenylethyl)-1,7,10,13,17,23,26,29,32,35,38-undecazatetracyclo[38.3.0.03,7.019,23]tritetracontan-16-yl]-4-hydroxy-5-phenylpentan-2-yl] 2-[acetyl(methyl)amino]-4-methylpentanoate

• 分子结构分类: 有机化合物 - 有机聚合物 - 多肽
• 英文名称: [1-[12-(3-Amino-3-oxopropyl)-37-butan-2-yl-31-ethylidene-15-hydroxy-28-(1-hydroxyethyl)-34-(hydroxymethyl)-2,8,11,14,18,24,27,30,33,36,39-undecaoxo-25-(2-phenylethyl)-1,7,10,13,17,23,26,29,32,35,38-undecazatetracyclo[38.3.0.03,7.019,23]tritetracontan-16-yl]-4-hydroxy-5-phenylpentan-2-yl] 2-[acetyl(methyl)amino]-4-methylpentanoate
• 英文别名: [1-[12-(3-amino-3-oxopropyl)-37-butan-2-yl-31-ethylidene-15-hydroxy-28-(1-hydroxyethyl)-34-(hydroxymethyl)-2,8,11,14,18,24,27,30,33,36,39-undecaoxo-25-(2-phenylethyl)-1,7,10,13,17,23,26,29,32,35,38-undecazatetracyclo[38.3.0.03,7.019,23]tritetracontan-16-yl]-4-hydroxy-5-phenylpentan-2-yl] 2-[acetyl(methyl)amino]-4-methylpentanoate
• 化学式: C₇₂H₁₀₅N₁₃O₁₉
• 分子量: 1456.7
• InChiKey: MTUBMTPWQGVXCG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  104
• 可旋转键数：
  22
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  464
• 氢给体数：
  13
• 氢受体数：
  19