38-[2-[2-(1,2,3,6a,7,8,9,10,10a,10b-Decahydroimidazo[5,1-a]isoquinolin-8-yl)-3,4-dihydroxybutyl]furan-3-yl]-44-(3-benzylcyclohexyl)-45-hydroxy-37-methyl-3,7,39,42-tetraoxatetradecacyclo[33.12.1.01,6.05,33.06,27.08,25.08,47.011,24.015,24.016,21.029,33.037,43.041,43.044,48]octatetraconta-12,26-diene-4,40,46-trione

• 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: 38-[2-[2-(1,2,3,6a,7,8,9,10,10a,10b-Decahydroimidazo[5,1-a]isoquinolin-8-yl)-3,4-dihydroxybutyl]furan-3-yl]-44-(3-benzylcyclohexyl)-45-hydroxy-37-methyl-3,7,39,42-tetraoxatetradecacyclo[33.12.1.01,6.05,33.06,27.08,25.08,47.011,24.015,24.016,21.029,33.037,43.041,43.044,48]octatetraconta-12,26-diene-4,40,46-trione
• 英文别名: 38-[2-[2-(1,2,3,6a,7,8,9,10,10a,10b-decahydroimidazo[5,1-a]isoquinolin-8-yl)-3,4-dihydroxybutyl]furan-3-yl]-44-(3-benzylcyclohexyl)-45-hydroxy-37-methyl-3,7,39,42-tetraoxatetradecacyclo[33.12.1.01,6.05,33.06,27.08,25.08,47.011,24.015,24.016,21.029,33.037,43.041,43.044,48]octatetraconta-12,26-diene-4,40,46-trione
• 化学式: C₇₇H₉₆N₂O₁₁
• 分子量: 1225.6
• InChiKey: BUJFALOAUXLSOE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.2
• 重原子数：
  90
• 可旋转键数：
  9
• 环数：
  20.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  181
• 氢给体数：
  4
• 氢受体数：
  13