[4,5-diacetyloxy-3-[[4-acetyloxy-8-[[4-acetyloxy-8-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-6-(1,2,4,5,6-pentaacetyloxyhexan-3-yloxy)oxan-2-yl]methyl acetate | 113647-96-4

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: [4,5-diacetyloxy-3-[[4-acetyloxy-8-[[4-acetyloxy-8-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-6-(1,2,4,5,6-pentaacetyloxyhexan-3-yloxy)oxan-2-yl]methyl acetate
• CAS: 113647-96-4
• 化学式: C₅₈H₇₈O₃₈
• 分子量: 1383.23
• InChiKey: PVSNLMIRLFRPSX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.2
• 重原子数：
  96
• 可旋转键数：
  43
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.76
• 拓扑面积：
  461
• 氢给体数：
  0
• 氢受体数：
  38

反应信息

• 作为产物：
  描述：

  乙酸酐 、 3''',6''';3'',6''-dianhydromaltopentaose 以 吡啶 为溶剂， 反应 48.0h， 生成 [4,5-diacetyloxy-3-[[4-acetyloxy-8-[[4-acetyloxy-8-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-6-(1,2,4,5,6-pentaacetyloxyhexan-3-yloxy)oxan-2-yl]methyl acetate
  参考文献：
  名称：

  Synthesis of 6A,6X-di-O-(p-tosyl)-.gamma.-cyclodextrins and their structural determination through enzymic hydrolysis of 3A,6A;3X,6X-dianhydro-.gamma.-cyclodextrins

  摘要：

  DOI：

  10.1021/jo00244a018