24-[7-[3-amino-1,3-dihydroxy-2-[[2-[(3-methylcyclohexyl)amino]ethylamino]methyl]propyl]-7-(1H-imidazol-5-yl)-2-oxospiro[1,3a,4,7a-tetrahydroindole-3,1'-cyclopentane]-4-yl]-25-hydroxy-16,27-bis(hydroxymethyl)-2,16,23,27-tetramethyl-26-(3,4,5-trihydroxyoxan-2-yl)oxy-6,8,10-triazaoctacyclo[19.9.3.01,22.02,19.03,12.05,9.013,18.023,28]tritriaconta-5(9),7,19-triene-13-carboxylic acid

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 24-[7-[3-amino-1,3-dihydroxy-2-[[2-[(3-methylcyclohexyl)amino]ethylamino]methyl]propyl]-7-(1H-imidazol-5-yl)-2-oxospiro[1,3a,4,7a-tetrahydroindole-3,1'-cyclopentane]-4-yl]-25-hydroxy-16,27-bis(hydroxymethyl)-2,16,23,27-tetramethyl-26-(3,4,5-trihydroxyoxan-2-yl)oxy-6,8,10-triazaoctacyclo[19.9.3.01,22.02,19.03,12.05,9.013,18.023,28]tritriaconta-5(9),7,19-triene-13-carboxylic acid
• 化学式: C₇₀H₁₀₇N₉O₁₃
• 分子量: 1282.6
• InChiKey: SUJHSIPGIAGIBE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  92
• 可旋转键数：
  16
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  366
• 氢给体数：
  16
• 氢受体数：
  19