(2R,3S,4S,5S,6R)-2-methyl-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(2-hydroxyethyl)oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxane-3,4,5-triol | 1200132-73-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (2R,3S,4S,5S,6R)-2-methyl-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(2-hydroxyethyl)oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxane-3,4,5-triol
• CAS: 1200132-73-5
• 化学式: C₈₀H₁₁₅N₂₇O₄₁
• 分子量: 2110.95
• InChiKey: CIKIPGHNNBHXBL-JHHXZVSESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -27.9
• 重原子数：
  148
• 可旋转键数：
  29
• 环数：
  19.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  996
• 氢给体数：
  31
• 氢受体数：
  59

反应信息

• 作为反应物：
  描述：

  (2R,3S,4S,5S,6R)-2-methyl-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(2-hydroxyethyl)oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxane-3,4,5-triol 、 乙酸酐 在 吡啶 作用下， 反应 16.0h， 生成
  参考文献：
  名称：

  Studies Toward the Synthesis of Inhibitors of Mycobacterium tuberculosis Cell-Wall Biosynthesis: The Assembly of Triazole-Linked 1,6-α-d-Oligomannosides via Click CuAAC

  摘要：

  通过铜（I）催化的叠氮-炔烃的迭代环加成反应，制备了以1,4-二取代三唑环为糖苷键的多功能1,6-α-二甘露糖苷。制备了具有封端6-脱氧甘露糖片段的游离羟基六甘露糖苷和十甘露糖苷，并对其进行了表征。

  DOI：

  10.1055/s-0029-1217751
• 作为产物：
  描述：

  在 氨 作用下， 以 甲醇 为溶剂， 反应 18.0h， 以99%的产率得到(2R,3S,4S,5S,6R)-2-methyl-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[1-[[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(2-hydroxyethyl)oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxan-2-yl]methyl]triazol-4-yl]oxane-3,4,5-triol
  参考文献：
  名称：

  Studies Toward the Synthesis of Inhibitors of Mycobacterium tuberculosis Cell-Wall Biosynthesis: The Assembly of Triazole-Linked 1,6-α-d-Oligomannosides via Click CuAAC

  摘要：

  通过铜（I）催化的叠氮-炔烃的迭代环加成反应，制备了以1,4-二取代三唑环为糖苷键的多功能1,6-α-二甘露糖苷。制备了具有封端6-脱氧甘露糖片段的游离羟基六甘露糖苷和十甘露糖苷，并对其进行了表征。

  DOI：

  10.1055/s-0029-1217751