2-[2-[2-[[17-(2,3-Dimethylbut-3-enyl)-16-hydroxy-2,6,6,10,16-pentamethyl-18,20-dioxahexacyclo[17.2.1.01,14.02,11.05,10.015,19]docosan-7-yl]oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl]oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol

• 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-[2-[2-[[17-(2,3-Dimethylbut-3-enyl)-16-hydroxy-2,6,6,10,16-pentamethyl-18,20-dioxahexacyclo[17.2.1.01,14.02,11.05,10.015,19]docosan-7-yl]oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl]oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
• 英文别名: 2-[2-[2-[[17-(2,3-dimethylbut-3-enyl)-16-hydroxy-2,6,6,10,16-pentamethyl-18,20-dioxahexacyclo[17.2.1.01,14.02,11.05,10.015,19]docosan-7-yl]oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl]oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
• 化学式: C₅₄H₈₈O₂₂
• 分子量: 1089.3
• InChiKey: QPZSVRPTMHZCKX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  76
• 可旋转键数：
  13
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.96
• 拓扑面积：
  335
• 氢给体数：
  12
• 氢受体数：
  22