7-O-(beta-羟基乙基)槲皮素 | 51031-80-2

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 黄酮类化合物
• 中文名称: 7-O-(beta-羟基乙基)槲皮素
• 中文别名: 苯,1-氟-4-[2-[(反,反)-4'-丙基[1,1'-联环己基]-4-基]乙基]-
• 英文名称: 2-(3,4-dihydroxy-phenyl)-3,5-dihydroxy-7-(2-hydroxy-ethoxy)-chromen-4-one
• 英文别名: 7-O-(beta-Hydroxyethyl)quercetin；2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-(2-hydroxyethoxy)chromen-4-one
• CAS: 51031-80-2
• 化学式: C₁₇H₁₄O₈
• 分子量: 346.293
• InChiKey: IPZVUNZAIXQPAT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  25
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  137
• 氢给体数：
  5
• 氢受体数：
  8

安全信息

• 海关编码：
  2914509090

文献信息

• PHARMACEUTICAL COMPOSITIONS COMPRISING A HYDROXYETHYLQUERCETIN GLUCURONIDE
  申请人：Janssen Pharmaceutica N.V.

  公开号：EP3860617A1

  公开（公告）日：2021-08-11
• Pharmaceutical Compositions Comprising a Hydroxyethylquercetin Glucuronide
  申请人：JANSSEN PHARMACEUTICA NV

  公开号：US20200155584A1

  公开（公告）日：2020-05-21

  Disclosed herein are hydroxyethylquercetin glycosides, including compounds of Structural Formulas I, II, III and IV. The compounds disclosed are useful for inhibiting norepinephrine metabolism and treating antenatal and postnatal depression in subjects in need thereof.
• [EN] PHARMACEUTICAL COMPOSITIONS COMPRISING A HYDROXYETHYLQUERCETIN GLUCURONIDE<br/>[FR] COMPOSITIONS PHARMACEUTIQUES COMPRENANT UN GLUCURONIDE D'HYDROXYÉTHYLQUERCÉTINE
  申请人：JANSSEN PHARMACEUTICA NV

  公开号：WO2020070643A1

  公开（公告）日：2020-04-09

  Disclosed herein are pharmaceutical compositions comprising hydroxyethylquercetin glucuronides, including compounds of Structural Formulas I, II, III and IV. The compounds disclosed are useful for inhibiting norepinephrine metabolism and treating antenatal and postnatal depression in subjects in need thereof.