5-Chlorosalicylic acid (BioDeep_00000174680)

   

human metabolite blood metabolite


代谢物信息卡片


5-Chloro-2-hydroxybenzoic acid

化学式: C7H5ClO3 (171.99272100000002)
中文名称: 5-氯水杨酸
谱图信息: 最多检出来源 Homo sapiens(blood) 65.33%

分子结构信息

SMILES: C1=CC(=C(C=C1Cl)C(=O)O)O
InChI: InChI=1S/C7H5ClO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9H,(H,10,11)

描述信息

D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates

同义名列表

7 个代谢物同义名

5-Chloro-2-hydroxybenzoic acid; 2-Hydroxy-5-chlorobenzoic acid; 2-Hydroxy-5-chlorobenzoate; 5-Chloro-2-hydroxybenzoate; 5-CHLOROSALICYLIC ACID; 5-Chlorosalicylate; 5 CSA



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

0 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(0)

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

  • Debarati Ray, Bijan Kumar Paul, Nikhil Guchhait. Effect of biological confinement on the photophysics and dynamics of a proton-transfer phototautomer: an exploration of excitation and emission wavelength-dependent photophysics of the protein-bound drug. Physical chemistry chemical physics : PCCP. 2012 Sep; 14(35):12182-92. doi: 10.1039/c2cp41292f. [PMID: 22870509]
  • Wolfgang Moeder, Huoi Ung, Stephen Mosher, Keiko Yoshioka. SA-ABA antagonism in defense responses. Plant signaling & behavior. 2010 Oct; 5(10):1231-3. doi: 10.4161/psb.5.10.12836. [PMID: 20861686]
  • Beatriz Cámara, Macarena Marín, Michael Schlömann, Hans-Jürgen Hecht, Howard Junca, Dietmar H Pieper. trans-Dienelactone hydrolase from Pseudomonas reinekei MT1, a novel zinc-dependent hydrolase. Biochemical and biophysical research communications. 2008 Nov; 376(2):423-8. doi: 10.1016/j.bbrc.2008.09.006. [PMID: 18789896]
  • Maija Koljonen, Katja Rousu, Jakub Cierny, Ann Marie Kaukonen, Jouni Hirvonen. Transport evaluation of salicylic acid and structurally related compounds across Caco-2 cell monolayers and artificial PAMPA membranes. European journal of pharmaceutics and biopharmaceutics : official journal of Arbeitsgemeinschaft fur Pharmazeutische Verfahrenstechnik e.V. 2008 Oct; 70(2):531-8. doi: 10.1016/j.ejpb.2008.05.017. [PMID: 18582575]
  • F Paul Silverman, Peter D Petracek, Daniel F Heiman, Christina M Fledderman, Prem Warrior. Salicylate activity. 3. Structure relationship to systemic acquired resistance. Journal of agricultural and food chemistry. 2005 Dec; 53(25):9775-80. doi: 10.1021/jf051383t. [PMID: 16332130]
  • F Paul Silverman, Peter D Petracek, Christina M Fledderman, Zhiguo Ju, Daniel F Heiman, Prem Warrior. Salicylate activity. 1. Protection of plants from paraquat injury. Journal of agricultural and food chemistry. 2005 Dec; 53(25):9764-8. doi: 10.1021/jf0513819. [PMID: 16332128]
  • Loretta Aureli, Gabriele Cruciani, Maria Candida Cesta, Roberto Anacardio, Lucio De Simone, Alessio Moriconi. Predicting human serum albumin affinity of interleukin-8 (CXCL8) inhibitors by 3D-QSPR approach. Journal of medicinal chemistry. 2005 Apr; 48(7):2469-79. doi: 10.1021/jm049227l. [PMID: 15801837]
  • R A Scherrer, S M Howard. Use of distribution coefficients in quantitative structure-activity relationships. Journal of medicinal chemistry. 1977 Jan; 20(1):53-8. doi: 10.1021/jm00211a010. [PMID: 13215]