37'-[2-(1,2,3,6a,7,8,9,10,10a,10b-Decahydroimidazo[5,1-a]isoquinolin-8-yl)-3,4-dihydroxybutyl]-49'-benzyl-2'-hydroxy-4,29'-dimethylspiro[1,2,3,3a,4,7a-hexahydroindene-5,16'-7,11,31,34,38-pentaoxapentadecacyclo[25.24.1.01,30.04,12.05,10.05,52.09,25.010,19.012,17.021,25.029,35.030,32.035,43.036,40.046,51]dopentaconta-18,36,39-trien-44-yne]-3',8',33'-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: 37'-[2-(1,2,3,6a,7,8,9,10,10a,10b-Decahydroimidazo[5,1-a]isoquinolin-8-yl)-3,4-dihydroxybutyl]-49'-benzyl-2'-hydroxy-4,29'-dimethylspiro[1,2,3,3a,4,7a-hexahydroindene-5,16'-7,11,31,34,38-pentaoxapentadecacyclo[25.24.1.01,30.04,12.05,10.05,52.09,25.010,19.012,17.021,25.029,35.030,32.035,43.036,40.046,51]dopentaconta-18,36,39-trien-44-yne]-3',8',33'-trione
• 英文别名: 37'-[2-(1,2,3,6a,7,8,9,10,10a,10b-decahydroimidazo[5,1-a]isoquinolin-8-yl)-3,4-dihydroxybutyl]-49'-benzyl-2'-hydroxy-4,29'-dimethylspiro[1,2,3,3a,4,7a-hexahydroindene-5,16'-7,11,31,34,38-pentaoxapentadecacyclo[25.24.1.01,30.04,12.05,10.05,52.09,25.010,19.012,17.021,25.029,35.030,32.035,43.036,40.046,51]dopentaconta-18,36,39-trien-44-yne]-3',8',33'-trione
• 化学式: C₇₉H₉₄N₂O₁₁
• 分子量: 1247.6
• InChiKey: IRCLGPAQKZNCDP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.3
• 重原子数：
  92
• 可旋转键数：
  7
• 环数：
  21.0
• 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