19-[(2,5-dioxopyrrol-1-yl)methyl]-27-(1-ethylcyclopentyl)-9-[[2-hydroxy-2-[2-(1H-imidazol-5-ylmethyl)cyclohexyl]ethyl]amino]-8-[3-(hydroxymethyl)-5-(1-hydroxy-2-phenylethyl)-10-bicyclo[7.3.1]tridec-6-ynyl]-4,29-dioxa-10,11-dithia-13,15-diazaoctacyclo[19.11.2.114,18.124,28.01,5.02,20.022,32.031,35]hexatriaconta-2(20),5,14(36),17,27,31(35)-hexaene-3,30-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: 19-[(2,5-dioxopyrrol-1-yl)methyl]-27-(1-ethylcyclopentyl)-9-[[2-hydroxy-2-[2-(1H-imidazol-5-ylmethyl)cyclohexyl]ethyl]amino]-8-[3-(hydroxymethyl)-5-(1-hydroxy-2-phenylethyl)-10-bicyclo[7.3.1]tridec-6-ynyl]-4,29-dioxa-10,11-dithia-13,15-diazaoctacyclo[19.11.2.114,18.124,28.01,5.02,20.022,32.031,35]hexatriaconta-2(20),5,14(36),17,27,31(35)-hexaene-3,30-dione
• 化学式: C₇₆H₉₄N₆O₉S₂
• 分子量: 1299.7
• InChiKey: PDTZTYLHQUZJNG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.8
• 重原子数：
  93
• 可旋转键数：
  15
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  266
• 氢给体数：
  7
• 氢受体数：
  15