3'-O-(1-phenyltetrazol-5-yl)diosmin | 771480-96-7

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 黄酮类化合物
• 英文名称: 3'-O-(1-phenyltetrazol-5-yl)diosmin
• 英文别名: 5-hydroxy-2-[4-methoxy-3-(1-phenyltetrazol-5-yl)oxyphenyl]-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
• CAS: 771480-96-7
• 化学式: C₃₅H₃₆N₄O₁₅
• 分子量: 752.689
• InChiKey: ZFSROIUMCMWDRQ-HWNBSROASA-N

物化性质

• 熔点：
  175-177 °C
• 沸点：
  1035.6±75.0 °C(Predicted)
• 密度：
  1.70±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  54
• 可旋转键数：
  10
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  267
• 氢给体数：
  7
• 氢受体数：
  18

反应信息

• 作为反应物：
  描述：

  3'-O-(1-phenyltetrazol-5-yl)diosmin 在 palladium on activated charcoal 甲酸铵 作用下， 以 甲醇 为溶剂， 反应 5.0h， 以53%的产率得到蒙花苷
  参考文献：
  名称：

  Semisynthesis of Linarin, Acacetin, and 6-Iodoapigenin Derivatives from Diosmin

  摘要：

  Semisynthesis of linarin and acacetin from the Citrus flavonoid diosmin was performed via, as first intermediate, the 3'-O-phenyltetrazolyl ether of diosmin. This paper relates also a semisynthetic access to 6-iodoapigenin derivatives, which are key compounds in the synthesis of some biflavonoids such as robustaflavone.

  DOI：

  10.1021/np040079b
• 作为产物：
  描述：

  5-氯-1-苯基-1H-四唑 、 地奥司明 在 potassium hydrogencarbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 2.0h， 以40%的产率得到3'-O-(1-phenyltetrazol-5-yl)diosmin
  参考文献：
  名称：

  Semisynthesis of Linarin, Acacetin, and 6-Iodoapigenin Derivatives from Diosmin

  摘要：

  Semisynthesis of linarin and acacetin from the Citrus flavonoid diosmin was performed via, as first intermediate, the 3'-O-phenyltetrazolyl ether of diosmin. This paper relates also a semisynthetic access to 6-iodoapigenin derivatives, which are key compounds in the synthesis of some biflavonoids such as robustaflavone.

  DOI：

  10.1021/np040079b

文献信息

• Semisynthesis of Linarin, Acacetin, and 6-Iodoapigenin Derivatives from Diosmin
  作者：Jérôme Quintin、Guy Lewin

  DOI：10.1021/np040079b

  日期：2004.9.1

  Semisynthesis of linarin and acacetin from the Citrus flavonoid diosmin was performed via, as first intermediate, the 3'-O-phenyltetrazolyl ether of diosmin. This paper relates also a semisynthetic access to 6-iodoapigenin derivatives, which are key compounds in the synthesis of some biflavonoids such as robustaflavone.