8-[3,5-Bis(hydroxymethyl)-10-bicyclo[7.3.1]tridec-6-ynyl]-9-[(2-cyclohexyl-2-hydroxyethyl)amino]-19-[(2,5-dioxopyrrol-1-yl)methyl]-26-[(1-ethylcyclopentyl)methylidene]-4,27-dioxa-10,11-dithia-13,15-diazaheptacyclo[19.9.2.114,18.01,5.02,20.022,30.025,29]tritriaconta-2(20),5,14(33),17,25(29)-pentaene-3,28-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: 8-[3,5-Bis(hydroxymethyl)-10-bicyclo[7.3.1]tridec-6-ynyl]-9-[(2-cyclohexyl-2-hydroxyethyl)amino]-19-[(2,5-dioxopyrrol-1-yl)methyl]-26-[(1-ethylcyclopentyl)methylidene]-4,27-dioxa-10,11-dithia-13,15-diazaheptacyclo[19.9.2.114,18.01,5.02,20.022,30.025,29]tritriaconta-2(20),5,14(33),17,25(29)-pentaene-3,28-dione
• 英文别名: 8-[3,5-bis(hydroxymethyl)-10-bicyclo[7.3.1]tridec-6-ynyl]-9-[(2-cyclohexyl-2-hydroxyethyl)amino]-19-[(2,5-dioxopyrrol-1-yl)methyl]-26-[(1-ethylcyclopentyl)methylidene]-4,27-dioxa-10,11-dithia-13,15-diazaheptacyclo[19.9.2.114,18.01,5.02,20.022,30.025,29]tritriaconta-2(20),5,14(33),17,25(29)-pentaene-3,28-dione
• 化学式: C₆₃H₈₂N₄O₉S₂
• 分子量: 1103.5
• InChiKey: QAFQZHMDUSGYCK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.8
• 重原子数：
  78
• 可旋转键数：
  11
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.68
• 拓扑面积：
  237
• 氢给体数：
  6
• 氢受体数：
  14