| 204199-54-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• CAS: 204199-54-2
• 化学式: C₈₇H₉₈Cl₃NO₂₆
• 分子量: 1680.09
• InChiKey: ZDFANKBFOUNUSD-MKGMSGRMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.16
• 重原子数：
  117.0
• 可旋转键数：
  38.0
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  310.05
• 氢给体数：
  2.0
• 氢受体数：
  26.0

反应信息

• 作为反应物：
  描述：

  在 锌 作用下， 以 水 、 溶剂黄146 为溶剂， 反应 3.0h， 生成
  参考文献：
  名称：

  Synthesis of Glycoconjugate Vaccines against Shigella dysenteriae Type 1

  摘要：

  Syntheses of a hexadecasaccharide and smaller fragments corresponding to one-four repeating units of the O-specific polysaccharide of Shigella dysenteriae type 1 are reported in a reactive aglyconlinked from. Two tetrasaccharide donor/acceptor repeating units were assembled from monosaccharide precursors in a stepwise fashion and used in a linear, iterative manner to construct the higher-membered saccharides using Schmidt's glycosylation technique that proved superior to others tested. Single-point attachment of the saccharides to human serum albumin, using a secondary heterobifunctional spacer, afforded a range of glycoconjugates for a detailed evaluation of their immunological characteristics.

  DOI：

  10.1021/jo980660a
• 作为产物：
  描述：

  在 硫脲 作用下， 以 吡啶 、 N,N-二甲基甲酰胺 为溶剂， 反应 24.0h， 以96%的产率得到
  参考文献：
  名称：

  Synthesis of Glycoconjugate Vaccines against Shigella dysenteriae Type 1

  摘要：

  Syntheses of a hexadecasaccharide and smaller fragments corresponding to one-four repeating units of the O-specific polysaccharide of Shigella dysenteriae type 1 are reported in a reactive aglyconlinked from. Two tetrasaccharide donor/acceptor repeating units were assembled from monosaccharide precursors in a stepwise fashion and used in a linear, iterative manner to construct the higher-membered saccharides using Schmidt's glycosylation technique that proved superior to others tested. Single-point attachment of the saccharides to human serum albumin, using a secondary heterobifunctional spacer, afforded a range of glycoconjugates for a detailed evaluation of their immunological characteristics.

  DOI：

  10.1021/jo980660a