3-(Carboxymethyl)-1-[2-(2,2-dimethylbutanoyloxy)-1-hydroxyethyl]-4-prop-1-en-2-ylpyrrolidine-2-carboxylic acid;2-cyclohexyl-2-(2,2-dimethylbutanoyloxy)acetic acid;2-cyclohexyl-3-[2-(2,2-dimethylbutanoyloxy)ethylamino]-3-oxopropanoic acid;2-[[3-(2,2-dimethylbutanoyloxy)-2-hydroxypropyl]amino]bicyclo[2.2.1]heptane-2-carboxylic acid

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 3-(Carboxymethyl)-1-[2-(2,2-dimethylbutanoyloxy)-1-hydroxyethyl]-4-prop-1-en-2-ylpyrrolidine-2-carboxylic acid;2-cyclohexyl-2-(2,2-dimethylbutanoyloxy)acetic acid;2-cyclohexyl-3-[2-(2,2-dimethylbutanoyloxy)ethylamino]-3-oxopropanoic acid;2-[[3-(2,2-dimethylbutanoyloxy)-2-hydroxypropyl]amino]bicyclo[2.2.1]heptane-2-carboxylic acid
• 英文别名: 3-(carboxymethyl)-1-[2-(2,2-dimethylbutanoyloxy)-1-hydroxyethyl]-4-prop-1-en-2-ylpyrrolidine-2-carboxylic acid;2-cyclohexyl-2-(2,2-dimethylbutanoyloxy)acetic acid;2-cyclohexyl-3-[2-(2,2-dimethylbutanoyloxy)ethylamino]-3-oxopropanoic acid;2-[[3-(2,2-dimethylbutanoyloxy)-2-hydroxypropyl]amino]bicyclo[2.2.1]heptane-2-carboxylic acid
• 化学式: C66H111N3O21
• 分子量: 1282.6
• InChiKey: AQEUGVWUMYHLQU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.26
• 重原子数：
  90
• 可旋转键数：
  34
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.82
• 拓扑面积：
  377
• 氢给体数：
  9
• 氢受体数：
  23