(4-(beta-D-吡喃葡萄糖基氧基)苯基)苯基甲酮半水合物 | 83355-65-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: (4-(beta-D-吡喃葡萄糖基氧基)苯基)苯基甲酮半水合物
• 中文别名: 1-氧杂螺[2.3]己烷-2-甲醇
• 英文名称: Phenyl-[4-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-phenyl]-methanone
• 英文别名: Methanone, (4-(beta-D-glucopyranosyloxy)phenyl)phenyl-, hemihydrate；phenyl-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methanone
• CAS: 83355-65-1
• 化学式: C₁₉H₂₀O₇
• 分子量: 360.364
• InChiKey: ZCXWHGXLVGHPKE-IQZDNPOKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  26
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  116
• 氢给体数：
  4
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  4-羟基-二苯甲酮 在 sodium methylate 、 silver(l) oxide 作用下， 以 甲醇 、 乙腈 为溶剂， 反应 2.5h， 生成 (4-(beta-D-吡喃葡萄糖基氧基)苯基)苯基甲酮半水合物
  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

文献信息

• Glycosylated derivatives of benzophenone, benzhydrol and benzhydril as potential venous antithrombotic agents
  作者：Francois Bellamy、Derek Horton、Jean Millet、Francois Picart、Soth Samreth、Jean Bernard Chazan

  DOI：10.1021/jm00059a015

  日期：1993.4

  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.