[2-[(6-Cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;methyl 2-[2-(2,2-dimethylbutanoyloxy)acetyl]oxy-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-6-carboxylate;3-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]propyl 2,2-dimethylbutanoate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.03,7]decan-2-yl)oxy]ethyl] 2,2-dimethylbutanoate;[2-oxo-2-[[5-oxo-6-(trifluoromethyl)-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2,2-dimethylbutanoate

• 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: [2-[(6-Cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;methyl 2-[2-(2,2-dimethylbutanoyloxy)acetyl]oxy-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-6-carboxylate;3-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]propyl 2,2-dimethylbutanoate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.03,7]decan-2-yl)oxy]ethyl] 2,2-dimethylbutanoate;[2-oxo-2-[[5-oxo-6-(trifluoromethyl)-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2,2-dimethylbutanoate
• 英文别名: [2-[(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;methyl 2-[2-(2,2-dimethylbutanoyloxy)acetyl]oxy-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-6-carboxylate;3-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]propyl 2,2-dimethylbutanoate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.03,7]decan-2-yl)oxy]ethyl] 2,2-dimethylbutanoate;[2-oxo-2-[[5-oxo-6-(trifluoromethyl)-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2,2-dimethylbutanoate
• 化学式: C85H114F3NO32
• 分子量: 1718.8
• InChiKey: YEXWSMQIDCDTHY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.05
• 重原子数：
  121
• 可旋转键数：
  38
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.81
• 拓扑面积：
  437
• 氢给体数：
  0
• 氢受体数：
  36