9-Cyclopentyl-22-[2-(3,3-dimethyloxiran-2-yl)-2-hydroxyethyl]-15-hydroxy-9,13,18,22,32-pentamethyl-31-[[3-methyl-5-(oxan-4-yl)phenyl]methyl]-1,27-diazaoctacyclo[14.13.1.12,28.16,10.013,18.017,21.025,29.014,32]dotriaconta-2(31),17(21),25,28-tetraen-4-yne-8,20-dione

• 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: 9-Cyclopentyl-22-[2-(3,3-dimethyloxiran-2-yl)-2-hydroxyethyl]-15-hydroxy-9,13,18,22,32-pentamethyl-31-[[3-methyl-5-(oxan-4-yl)phenyl]methyl]-1,27-diazaoctacyclo[14.13.1.12,28.16,10.013,18.017,21.025,29.014,32]dotriaconta-2(31),17(21),25,28-tetraen-4-yne-8,20-dione
• 英文别名: 9-cyclopentyl-22-[2-(3,3-dimethyloxiran-2-yl)-2-hydroxyethyl]-15-hydroxy-9,13,18,22,32-pentamethyl-31-[[3-methyl-5-(oxan-4-yl)phenyl]methyl]-1,27-diazaoctacyclo[14.13.1.12,28.16,10.013,18.017,21.025,29.014,32]dotriaconta-2(31),17(21),25,28-tetraen-4-yne-8,20-dione
• 化学式: C₅₉H₇₆N₂O₆
• 分子量: 909.2
• InChiKey: XPSYRXLZAKOMFK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.4
• 重原子数：
  67
• 可旋转键数：
  7
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  117
• 氢给体数：
  3
• 氢受体数：
  6