3-(4-Fluorobenzoyl)propionic acid (BioDeep_00000173829)

   

human metabolite blood metabolite Volatile Flavor Compounds


代谢物信息卡片


(18F)-beta-(4-Fluorobenzoyl)propionic acid

化学式: C10H9FO3 (196.05356959999997)
中文名称: 3-(4-氟苯甲酰)丙酸, 3-（4-氟苯甲酰基）丙酸
谱图信息: 最多检出来源 Homo sapiens(blood) 22.58%

分子结构信息

SMILES: C1=CC(=CC=C1C(=O)CCC(=O)O)F
InChI: InChI=1S/C10H9FO3/c11-8-3-1-7(2-4-8)9(12)5-6-10(13)14/h1-4H,5-6H2,(H,13,14)

描述信息

同义名列表

7 个代谢物同义名

(18F)-beta-(4-Fluorobenzoyl)propionic acid; 4-(4-fluorophenyl)-4-oxobutanoic acid; beta-(4-Fluorobenzoyl)propionic acid; 3-(4-Fluorobenzoyl)propionic acid; 3-(4-Fluorobenzoyl)propionate; 4-FBPA; 3-(4-Fluorobenzoyl)propionic acid



数据库引用编号

6 个数据库交叉引用编号

分类词条

相关代谢途径

Reactome(0)

BioCyc(0)

PlantCyc(0)

代谢反应

1 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(0)

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(0)

COVID-19 Disease Map(0)

PathBank(0)

PharmGKB(1)

1 个相关的物种来源信息

在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有：

  • PubMed: 来源于PubMed文献库中的文献信息，我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表，这个列表按照代谢物同时出现的文献数量降序排序，取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
  • NCBI Taxonomy: 通过文献数据挖掘，得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序，取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
  • Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
  • Chemical Reaction: 在化学反应过程中，存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。

点击图上的相关代谢物的名称，可以跳转到相关代谢物的信息页面。



文献列表

  • A B Skorniakova, D S Lazarian. [Chemical toxicological analysis of haloperidol metabolite 4-(4-chlorophenyl)-4-hydroxypipiridine in urine by high-performance liquid chromatography]. Sudebno-meditsinskaia ekspertiza. 2009 Jan; 52(1):45-8. doi: NULL. [PMID: 19371012]
  • Yasuhiko Higashi, Miyuki Kitahara, Youichi Fujii. Simultaneous analysis of haloperidol, its three metabolites and two other butyrophenone-type neuroleptics by high performance liquid chromatography with dual ultraviolet detection. Biomedical chromatography : BMC. 2006 Feb; 20(2):166-72. doi: 10.1002/bmc.547. [PMID: 16034821]
  • T Tateishi, M Watanabe, T Kumai, M Tanaka, H Moriya, S Yamaguchi, T Satoh, S Kobayashi. CYP3A is responsible for N-dealkylation of haloperidol and bromperidol and oxidation of their reduced forms by human liver microsomes. Life sciences. 2000 Nov; 67(24):2913-20. doi: 10.1016/s0024-3205(00)00874-2. [PMID: 11133003]
  • M Watanabe, T Tateishi, M Tanaka, T Kumai, S Kobayashi. Role of CYP3A in bromperidol metabolism in rat in vitro and in vivo. Xenobiotica; the fate of foreign compounds in biological systems. 1999 Aug; 29(8):839-46. doi: 10.1080/004982599238281. [PMID: 10553724]
  • L J Mienie, J J Bergh, J R Bloomquist, N Castagnoli, S J Steyn, C J Van der Schyf. p-Fluorophenylglycine in the urine of baboons treated with HPTP, the tetrahydropyridine analog of haloperidol. Life sciences. 1999; 65(5):535-42. doi: 10.1016/s0024-3205(99)00274-x. [PMID: 10462080]
  • M Watanabe, T Tateishi, M Asoh, H Nakura, M Tanaka, T Kumai, S Kobayashi. Role of CYP3A in haloperidol N-dealkylation and pharmacokinetics in rats. Fundamental & clinical pharmacology. 1999; 13(3):337-42. doi: 10.1111/j.1472-8206.1999.tb00353.x. [PMID: 10392310]