5-(1,4-Dibutoxy-3-methyl-1,4-dioxobutan-2-yl)-3-methoxycarbonyl-6-[4-[6-[(2-methylpropan-2-yl)oxycarbonyl]-3-(3,4,5-trihydroxy-9-methyl-4-azatricyclo[5.2.1.02,6]deca-2,5-dien-8-yl)-2-bicyclo[2.2.1]heptanyl]-2,5-dioxooxolan-3-yl]bicyclo[2.2.2]octane-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: 5-(1,4-Dibutoxy-3-methyl-1,4-dioxobutan-2-yl)-3-methoxycarbonyl-6-[4-[6-[(2-methylpropan-2-yl)oxycarbonyl]-3-(3,4,5-trihydroxy-9-methyl-4-azatricyclo[5.2.1.02,6]deca-2,5-dien-8-yl)-2-bicyclo[2.2.1]heptanyl]-2,5-dioxooxolan-3-yl]bicyclo[2.2.2]octane-2-carboxylic acid
• 英文别名: 5-(1,4-dibutoxy-3-methyl-1,4-dioxobutan-2-yl)-3-methoxycarbonyl-6-[4-[6-[(2-methylpropan-2-yl)oxycarbonyl]-3-(3,4,5-trihydroxy-9-methyl-4-azatricyclo[5.2.1.02,6]deca-2,5-dien-8-yl)-2-bicyclo[2.2.1]heptanyl]-2,5-dioxooxolan-3-yl]bicyclo[2.2.2]octane-2-carboxylic acid
• 化学式: C₅₀H₆₉NO₁₆
• 分子量: 940.1
• InChiKey: GKZPMFJWTPBPRH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.4
• 重原子数：
  67
• 可旋转键数：
  21
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  252
• 氢给体数：
  4
• 氢受体数：
  16