2-[[1-[[4-[[2-[(1-Benzyl-2,2,3,3,4,5,5,6,6-nonahydroxypiperidin-4-yl)methyl]-1,1,2,4,7-pentahydroxy-6-methoxy-3-oxoinden-5-yl]oxymethoxy]-2,3,5,6-tetrahydroxyphenyl]-dihydroxymethyl]piperidin-4-yl]methyl]-2,3,3,4,7-pentahydroxy-5,6-dimethoxyinden-1-one

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: 2-[[1-[[4-[[2-[(1-Benzyl-2,2,3,3,4,5,5,6,6-nonahydroxypiperidin-4-yl)methyl]-1,1,2,4,7-pentahydroxy-6-methoxy-3-oxoinden-5-yl]oxymethoxy]-2,3,5,6-tetrahydroxyphenyl]-dihydroxymethyl]piperidin-4-yl]methyl]-2,3,3,4,7-pentahydroxy-5,6-dimethoxyinden-1-one
• 英文别名: 2-[[1-[[4-[[2-[(1-benzyl-2,2,3,3,4,5,5,6,6-nonahydroxypiperidin-4-yl)methyl]-1,1,2,4,7-pentahydroxy-6-methoxy-3-oxoinden-5-yl]oxymethoxy]-2,3,5,6-tetrahydroxyphenyl]-dihydroxymethyl]piperidin-4-yl]methyl]-2,3,3,4,7-pentahydroxy-5,6-dimethoxyinden-1-one
• 化学式: C₄₈H₅₆N₂O₃₂
• 分子量: 1172.9
• InChiKey: HUMINZNERGDQBG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -6
• 重原子数：
  82
• 可旋转键数：
  15
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  593
• 氢给体数：
  25
• 氢受体数：
  34