34-[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]-40-(3-benzylcyclohexyl)-41-hydroxy-33-methylspiro[3,35,38,46-tetraoxahexadecacyclo[25.20.2.25,8.131,40.01,29.02,23.02,44.04,21.04,43.07,20.011,20.012,17.025,29.033,39.037,39.044,50]dopentaconta-8,18,22,48-tetraene-28,1'-cyclopentane]-36,42,47-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: 34-[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]-40-(3-benzylcyclohexyl)-41-hydroxy-33-methylspiro[3,35,38,46-tetraoxahexadecacyclo[25.20.2.25,8.131,40.01,29.02,23.02,44.04,21.04,43.07,20.011,20.012,17.025,29.033,39.037,39.044,50]dopentaconta-8,18,22,48-tetraene-28,1'-cyclopentane]-36,42,47-trione
• 英文别名: 34-[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]-40-(3-benzylcyclohexyl)-41-hydroxy-33-methylspiro[3,35,38,46-tetraoxahexadecacyclo[25.20.2.25,8.131,40.01,29.02,23.02,44.04,21.04,43.07,20.011,20.012,17.025,29.033,39.037,39.044,50]dopentaconta-8,18,22,48-tetraene-28,1'-cyclopentane]-36,42,47-trione
• 化学式: C₈₅H₁₀₂N₂O₁₁
• 分子量: 1327.7
• InChiKey: JWRQLLBIJLEPKI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13
• 重原子数：
  98
• 可旋转键数：
  9
• 环数：
  23.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  181
• 氢给体数：
  4
• 氢受体数：
  13