2,3,8-Trihydroxy-8a-[4-hydroxy-5-[3-(3-hydroxy-2-methylbutanoyl)oxy-2-methylbutanoyl]oxy-6-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxycarbonyl-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid

• 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: 2,3,8-Trihydroxy-8a-[4-hydroxy-5-[3-(3-hydroxy-2-methylbutanoyl)oxy-2-methylbutanoyl]oxy-6-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxycarbonyl-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid
• 英文别名: 2,3,8-trihydroxy-8a-[4-hydroxy-5-[3-(3-hydroxy-2-methylbutanoyl)oxy-2-methylbutanoyl]oxy-6-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxycarbonyl-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid
• 化学式: C₅₂H₈₂O₁₉
• 分子量: 1011.2
• InChiKey: OIXRHLRUGIWTTM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  71
• 可旋转键数：
  14
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  306
• 氢给体数：
  9
• 氢受体数：
  19