24-[2-(1,2,3,6a,7,8,9,10,10a,10b-Decahydroimidazo[5,1-a]isoquinolin-8-yl)-3,4-dihydroxybutyl]-12-benzyl-8-hydroxy-32,45-dimethyl-44-(2-methylpropyl)-3,23,27,30,46-pentaoxapentadecacyclo[36.9.2.15,9.01,36.05,47.06,45.09,31.010,15.018,26.021,25.026,32.029,31.036,40.042,47.034,50]pentaconta-21,24,42,48-tetraen-16-yne-2,7,28-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: 24-[2-(1,2,3,6a,7,8,9,10,10a,10b-Decahydroimidazo[5,1-a]isoquinolin-8-yl)-3,4-dihydroxybutyl]-12-benzyl-8-hydroxy-32,45-dimethyl-44-(2-methylpropyl)-3,23,27,30,46-pentaoxapentadecacyclo[36.9.2.15,9.01,36.05,47.06,45.09,31.010,15.018,26.021,25.026,32.029,31.036,40.042,47.034,50]pentaconta-21,24,42,48-tetraen-16-yne-2,7,28-trione
• 英文别名: 24-[2-(1,2,3,6a,7,8,9,10,10a,10b-decahydroimidazo[5,1-a]isoquinolin-8-yl)-3,4-dihydroxybutyl]-12-benzyl-8-hydroxy-32,45-dimethyl-44-(2-methylpropyl)-3,23,27,30,46-pentaoxapentadecacyclo[36.9.2.15,9.01,36.05,47.06,45.09,31.010,15.018,26.021,25.026,32.029,31.036,40.042,47.034,50]pentaconta-21,24,42,48-tetraen-16-yne-2,7,28-trione
• 化学式: C₇₃H₈₆N₂O₁₁
• 分子量: 1167.5
• InChiKey: RDYMRLOKJYBZPU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.1
• 重原子数：
  86
• 可旋转键数：
  9
• 环数：
  19.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  181
• 氢给体数：
  4
• 氢受体数：
  13