6-[4-(5-Methoxycarbonyl-3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)-2,5-dioxooxolan-3-yl]-5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylic acid;methyl 5-[4-[2,3-dimethyl-6-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propyl]-2-bicyclo[2.2.1]heptanyl]-2,5-dioxooxolan-3-yl]-6,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate

• 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: 6-[4-(5-Methoxycarbonyl-3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)-2,5-dioxooxolan-3-yl]-5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylic acid;methyl 5-[4-[2,3-dimethyl-6-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propyl]-2-bicyclo[2.2.1]heptanyl]-2,5-dioxooxolan-3-yl]-6,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate
• 英文别名: 6-[4-(5-methoxycarbonyl-3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)-2,5-dioxooxolan-3-yl]-5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylic acid;methyl 5-[4-[2,3-dimethyl-6-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propyl]-2-bicyclo[2.2.1]heptanyl]-2,5-dioxooxolan-3-yl]-6,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate
• 化学式: C53H70F6O13
• 分子量: 1029.1
• InChiKey: JZUBIMQPKIHPCU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.47
• 重原子数：
  72
• 可旋转键数：
  11
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.87
• 拓扑面积：
  197
• 氢给体数：
  2
• 氢受体数：
  19