15-[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]-8-benzyl-4-hydroxy-21-methyl-34-propan-2-yl-16,19,39,43-tetraoxatridecacyclo[21.21.1.01,40.02,38.05,20.05,45.06,11.015,21.018,20.025,29.025,41.031,40.033,38]pentatetracont-31-en-12-yne-3,17,42-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: 15-[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]-8-benzyl-4-hydroxy-21-methyl-34-propan-2-yl-16,19,39,43-tetraoxatridecacyclo[21.21.1.01,40.02,38.05,20.05,45.06,11.015,21.018,20.025,29.025,41.031,40.033,38]pentatetracont-31-en-12-yne-3,17,42-trione
• 英文别名: 15-[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]-8-benzyl-4-hydroxy-21-methyl-34-propan-2-yl-16,19,39,43-tetraoxatridecacyclo[21.21.1.01,40.02,38.05,20.05,45.06,11.015,21.018,20.025,29.025,41.031,40.033,38]pentatetracont-31-en-12-yne-3,17,42-trione
• 化学式: C₇₁H₈₆N₂O₁₁
• 分子量: 1143.4
• InChiKey: WQTHAPONWNDPEF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.5
• 重原子数：
  84
• 可旋转键数：
  9
• 环数：
  18.0
• 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