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]-21-(3-benzylcyclohexyl)-22-hydroxy-14-methylspiro[16,19,27,31-tetraoxapentadecacyclo[31.14.2.112,21.01,39.02,32.04,30.06,10.010,29.014,20.018,20.024,32.025,30.036,48.040,45.025,50]pentaconta-3,34,36,46-tetraene-8,1'-cyclopentane]-17,23,28-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: 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]-21-(3-benzylcyclohexyl)-22-hydroxy-14-methylspiro[16,19,27,31-tetraoxapentadecacyclo[31.14.2.112,21.01,39.02,32.04,30.06,10.010,29.014,20.018,20.024,32.025,30.036,48.040,45.025,50]pentaconta-3,34,36,46-tetraene-8,1'-cyclopentane]-17,23,28-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]-21-(3-benzylcyclohexyl)-22-hydroxy-14-methylspiro[16,19,27,31-tetraoxapentadecacyclo[31.14.2.112,21.01,39.02,32.04,30.06,10.010,29.014,20.018,20.024,32.025,30.036,48.040,45.025,50]pentaconta-3,34,36,46-tetraene-8,1'-cyclopentane]-17,23,28-trione
• 化学式: C₈₃H₁₀₀N₂O₁₁
• 分子量: 1301.7
• InChiKey: LPGYDYHUEIYBEL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.1
• 重原子数：
  96
• 可旋转键数：
  9
• 环数：
  22.0
• sp3杂化的碳原子比例：
  0.72
• 拓扑面积：
  181
• 氢给体数：
  4
• 氢受体数：
  13