2-Adamantyl 5-(2-methylbutanoyloxy)pentanoate;[4-(2-adamantyloxy)-4-oxobutan-2-yl] 2-methylbutanoate;[4-(2-adamantyloxy)-4-oxobutyl] 2-methylbutanoate;[1-(2-adamantyloxy)-1-oxopropan-2-yl] 2-methylbutanoate;[3-[(2-methyl-2-adamantyl)oxy]-3-oxopropyl] 2-methylbutanoate

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: 2-Adamantyl 5-(2-methylbutanoyloxy)pentanoate;[4-(2-adamantyloxy)-4-oxobutan-2-yl] 2-methylbutanoate;[4-(2-adamantyloxy)-4-oxobutyl] 2-methylbutanoate;[1-(2-adamantyloxy)-1-oxopropan-2-yl] 2-methylbutanoate;[3-[(2-methyl-2-adamantyl)oxy]-3-oxopropyl] 2-methylbutanoate
• 英文别名: 2-adamantyl 5-(2-methylbutanoyloxy)pentanoate;[4-(2-adamantyloxy)-4-oxobutan-2-yl] 2-methylbutanoate;[4-(2-adamantyloxy)-4-oxobutyl] 2-methylbutanoate;[1-(2-adamantyloxy)-1-oxopropan-2-yl] 2-methylbutanoate;[3-[(2-methyl-2-adamantyl)oxy]-3-oxopropyl] 2-methylbutanoate
• 化学式: C95H150O20
• 分子量: 1612.2
• InChiKey: KQJOMAATNZDGHH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  18.62
• 重原子数：
  115
• 可旋转键数：
  42
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.89
• 拓扑面积：
  263
• 氢给体数：
  0
• 氢受体数：
  20