2-[[2-Hydroxy-4-(hydroxymethyl)-6-[[6,7,9,13-tetramethyl-6-[3-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]peroxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-16-yl]peroxymethyl]-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxycyclohexyl]methoxy]-6-methyloxane-3,4,5-triol

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 类固醇和类固醇衍生物
• 英文名称: 2-[[2-Hydroxy-4-(hydroxymethyl)-6-[[6,7,9,13-tetramethyl-6-[3-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]peroxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-16-yl]peroxymethyl]-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxycyclohexyl]methoxy]-6-methyloxane-3,4,5-triol
• 英文别名: 2-[[2-hydroxy-4-(hydroxymethyl)-6-[[6,7,9,13-tetramethyl-6-[3-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]peroxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-16-yl]peroxymethyl]-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxycyclohexyl]methoxy]-6-methyloxane-3,4,5-triol
• 化学式: C₅₅H₉₂O₂₂
• 分子量: 1105.3
• InChiKey: AHOMKRNLYYDBNV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.8
• 重原子数：
  77
• 可旋转键数：
  18
• 环数：
  9.0
• 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