6a-[[8a-carboxy-4,4,6a,11,12,14b-hexamethyl-6b-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl]oxycarbonyl]-10-hydroxy-1,2,6b,9,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-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: 6a-[[8a-carboxy-4,4,6a,11,12,14b-hexamethyl-6b-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl]oxycarbonyl]-10-hydroxy-1,2,6b,9,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
• 化学式: C₆₆H₁₀₀O₁₄
• 分子量: 1117.5
• InChiKey: JHESPRQPYSHGNS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.7
• 重原子数：
  80
• 可旋转键数：
  9
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  238
• 氢给体数：
  7
• 氢受体数：
  14