2-(1-Adamantyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;tert-butyl 9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;(1-methylcyclohexyl) 9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;(4-methyl-2-oxooxan-4-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;oxan-2-yl 9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-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: 2-(1-Adamantyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;tert-butyl 9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;(1-methylcyclohexyl) 9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;(4-methyl-2-oxooxan-4-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;oxan-2-yl 9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate
• 英文别名: 2-(1-adamantyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;tert-butyl 9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;(1-methylcyclohexyl) 9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;(4-methyl-2-oxooxan-4-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;oxan-2-yl 9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate
• 化学式: C100H154O13
• 分子量: 1564.3
• InChiKey: YHBMRRXGSGXNTR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  21.07
• 重原子数：
  113
• 可旋转键数：
  16
• 环数：
  23.0
• sp3杂化的碳原子比例：
  0.94
• 拓扑面积：
  167
• 氢给体数：
  0
• 氢受体数：
  13