18-[[2-Amino-6-(3-hydroxypropyl)-1,2-dihydropyridin-5-yl]methyl]-9,15,16-trihydroxy-6-[1-hydroxy-1-(7-hydroxy-13-propyl-9-oxatricyclo[8.5.0.02,8]pentadecan-7-yl)ethyl]-11-(2-hydroxypropylamino)-5-methylpentacyclo[12.3.3.01,13.02,10.05,9]icos-10-en-12-one

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 类固醇和类固醇衍生物
• 英文名称: 18-[[2-Amino-6-(3-hydroxypropyl)-1,2-dihydropyridin-5-yl]methyl]-9,15,16-trihydroxy-6-[1-hydroxy-1-(7-hydroxy-13-propyl-9-oxatricyclo[8.5.0.02,8]pentadecan-7-yl)ethyl]-11-(2-hydroxypropylamino)-5-methylpentacyclo[12.3.3.01,13.02,10.05,9]icos-10-en-12-one
• 英文别名: 18-[[2-amino-6-(3-hydroxypropyl)-1,2-dihydropyridin-5-yl]methyl]-9,15,16-trihydroxy-6-[1-hydroxy-1-(7-hydroxy-13-propyl-9-oxatricyclo[8.5.0.02,8]pentadecan-7-yl)ethyl]-11-(2-hydroxypropylamino)-5-methylpentacyclo[12.3.3.01,13.02,10.05,9]icos-10-en-12-one
• 化学式: C₅₂H₈₃N₃O₉
• 分子量: 894.2
• InChiKey: NEIAHIUHJHSYEV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  64
• 可旋转键数：
  12
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.87
• 拓扑面积：
  218
• 氢给体数：
  10
• 氢受体数：
  12