D-赤藓-五糖醇,3,4,5-三脱氧-3-[[(1,1-二甲基乙氧基)羰基]氨基]- | 83355-72-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: D-赤藓-五糖醇,3,4,5-三脱氧-3-[[(1,1-二甲基乙氧基)羰基]氨基]-
• 中文别名: (4-((6-脱氧-alpha-L-甘露糖基)氧基)苯基)(4-硝基苯基)甲酮
• 英文名称: (4-Nitro-phenyl)-[4-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-phenyl]-methanone
• 英文别名: Methanone, (4-((6-deoxy-alpha-L-mannopyranosyl)oxy)phenyl)(4-nitrophenyl)-；(4-nitrophenyl)-[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]methanone
• CAS: 83355-72-0
• 化学式: C₁₉H₁₉NO₈
• 分子量: 389.362
• InChiKey: UULSPKJPSGCIMK-IBTIDGEISA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  28
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  142
• 氢给体数：
  3
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  Acetic acid (2S,3S,4R,5R,6S)-3,5-diacetoxy-2-methyl-6-[4-(4-nitro-benzoyl)-phenoxy]-tetrahydro-pyran-4-yl ester 在 sodium methylate 作用下， 以 甲醇 为溶剂， 反应 2.0h， 生成 D-赤藓-五糖醇,3,4,5-三脱氧-3-[[(1,1-二甲基乙氧基)羰基]氨基]-
  参考文献：
  名称：

  Glycosylated derivatives of benzophenone, benzhydrol and benzhydril as potential venous antithrombotic agents

  摘要：

  A series of glycosylated derivatives of benzophenone, benzhydrol, and benzhydril has been synthesized and evaluated for potential activity as venous antithrombotic agents. Studies on structure-activity relationships revealed that compounds having an electron-withdrawing group in the benzhydril or benzhydrol moiety, and specifically those having the beta-D-xylopyranosyl structure in the sugar moiety, were good antithrombotic agents in a rat model of venous thrombosis.

  DOI：

  10.1021/jm00059a015