6-Hydroxyrebamipide | 90098-82-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 6-Hydroxyrebamipide
• 英文别名: 2-[(4-chlorobenzoyl)amino]-3-(6-hydroxy-2-oxo-1H-quinolin-4-yl)propanoic acid
• CAS: 90098-82-1
• 化学式: C₁₉H₁₅ClN₂O₅
• 分子量: 386.791
• InChiKey: IMRUHDNHNAKMPT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  27
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  116
• 氢给体数：
  4
• 氢受体数：
  5

ADMET

代谢

6-羟基雷巴米吡德是(R)-(+)-雷巴米吡德的人体已知代谢物。

6-Hydroxyrebamipide is a known human metabolite of (R)-(+)-Rebamipide.

来源:NORMAN Suspect List Exchange

反应信息

• 作为产物：
  描述：

  2-Amino-3-(6-hydroxy-2-quinolon-4-yl)propionic acid hydrochloride 生成 6-Hydroxyrebamipide
  参考文献：
  名称：

  UTIDA, MINORU;KOMATSU, MAKOTO;NAKAGAVA, KADZUYUKI

  摘要：

  DOI：

文献信息

• Studies on 2(1H)-quinolinone derivatives as gastric antiulcer active agents. Synthesis and antiulcer activity of the metabolites of 2-(4-chlorobenzoylamino)-3-(2(1H)-quinolinon-4-yl)propionic acid.
  作者：MINORU UDHIDA、FUJIO TABUSA、MAKOTO KOMATSU、SEIJI MORITA、TOSHIMI KANBE、KAZUYUKI NAKAGAWA

  DOI：10.1248/cpb.34.4821

  日期：——

  The metabolites of 2-(4-chlorobenzoylamino)-3-[2(1H)-quinolinon-4-yl]propionic acid (OPC-12759) (1), which has a potent antiulcer activity towards acetic acid-induced gastric ulcer, were synthesized to confirm their structures and to examine their antiulcer activity. The structures of the major metabolites (2-4) in the rat were identified by means of comparisons with the synthetic compounds. The antiulcer activity of the metabolites (2-4) was found to be lower than that of 1.

  2-(4-氯苯甲酰氨基)-3-[2(1H)-quinolinon-4-yl]丙酸 (OPC-12759) (1) 的代谢物，对乙酸诱导的胃溃疡具有有效的抗溃疡活性，合成以确认其结构并检查其抗溃疡活性。通过与合成化合物的比较，鉴定了大鼠主要代谢物 (2-4) 的结构。发现代谢物(2-4)的抗溃疡活性低于1。