Methyl 6-[[9-acetyloxy-7,8-dihydroxy-8a-(hydroxymethyl)-10-[3-hydroxy-6-methyl-4,5-bis(3-methylpent-2-enoyloxy)oxan-2-yl]oxy-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylate

• 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: Methyl 6-[[9-acetyloxy-7,8-dihydroxy-8a-(hydroxymethyl)-10-[3-hydroxy-6-methyl-4,5-bis(3-methylpent-2-enoyloxy)oxan-2-yl]oxy-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylate
• 英文别名: methyl 6-[[9-acetyloxy-7,8-dihydroxy-8a-(hydroxymethyl)-10-[3-hydroxy-6-methyl-4,5-bis(3-methylpent-2-enoyloxy)oxan-2-yl]oxy-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylate
• 化学式: C₆₃H₉₈O₂₄
• 分子量: 1239.4
• InChiKey: GBOBPCWXRIERFR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  87
• 可旋转键数：
  20
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.84
• 拓扑面积：
  363
• 氢给体数：
  10
• 氢受体数：
  24