6-[[9-Acetyloxy-8-hydroxy-4,8a-bis(hydroxymethyl)-10-[3-hydroxy-6-methyl-4,5-bis(2-methylbut-2-enoyloxy)oxan-2-yl]oxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-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: 6-[[9-Acetyloxy-8-hydroxy-4,8a-bis(hydroxymethyl)-10-[3-hydroxy-6-methyl-4,5-bis(2-methylbut-2-enoyloxy)oxan-2-yl]oxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
• 英文别名: 6-[[9-acetyloxy-8-hydroxy-4,8a-bis(hydroxymethyl)-10-[3-hydroxy-6-methyl-4,5-bis(2-methylbut-2-enoyloxy)oxan-2-yl]oxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
• 化学式: C₅₄H₈₂O₁₉
• 分子量: 1035.2
• InChiKey: APJPVHIHXTYLRS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  73
• 可旋转键数：
  15
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.81
• 拓扑面积：
  295
• 氢给体数：
  8
• 氢受体数：
  19