S-(1,2-Dichlorovinyl)-glutathione (BioDeep_00000173684)

   

human metabolite blood metabolite


代谢物信息卡片


2-Amino-4-({1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-[(1,2-dichloroethenyl)sulphanyl]ethyl}-C-hydroxycarbonimidoyl)butanoic acid

  化学式: C12H17Cl2N3O6S (401.0215)
中文名称:
  谱图信息: 最多检出来源 Mus musculus(not specific) 3.27%

分子结构信息

SMILES: NC(CCC(=O)NC(CSC(Cl)=CCl)C(=O)NCC(O)=O)C(O)=O
InChI: InChI=1S/C12H17Cl2N3O6S/c13-3-8(14)24-5-7(11(21)16-4-10(19)20)17-9(18)2-1-6(15)12(22)23/h3,6-7H,1-2,4-5,15H2,(H,16,21)(H,17,18)(H,19,20)(H,22,23)



数据库引用编号

3 个数据库交叉引用编号

分类词条

相关代谢途径

Reactome()

BioCyc()

PlantCyc()

代谢反应

个相关的代谢反应过程信息。

Reactome()

BioCyc()

WikiPathways()

Plant Reactome()

INOH()

PlantCyc()

COVID-19 Disease Map()

PathBank()

PharmGKB()

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。

亚细胞结构定位 关联基因列表
Cytoplasm 4 ANPEP, CYP2E1, HPGDS, KYAT1
Peripheral membrane protein 2 CYP2E1, HSD17B6
Endoplasmic reticulum membrane 2 CYP2E1, NAT8
Nucleus 2 ADK, ZFX
cytosol 4 ACOX1, ADK, HPGDS, KYAT1
nucleoplasm 3 ADK, HPGDS, ZFX
Cell membrane 1 ANPEP
Early endosome membrane 1 HSD17B6
Multi-pass membrane protein 1 ABCC3
lysosomal membrane 1 ANPEP
mitochondrial inner membrane 1 CYP2E1
Cytoplasm, cytosol 1 KYAT1
plasma membrane 3 ABCC3, ADK, ANPEP
Membrane 3 ABCC3, ACOX1, NAT8
basolateral plasma membrane 1 ABCC3
extracellular exosome 3 ALDH2, ANPEP, CFH
Lumenal side 1 HSD17B6
endoplasmic reticulum 1 HSD17B6
extracellular space 2 ANPEP, CFH
mitochondrion 2 ALDH2, KYAT1
intracellular membrane-bounded organelle 3 CYP2E1, HPGDS, HSD17B6
Microsome membrane 2 CYP2E1, HSD17B6
Secreted 1 CFH
extracellular region 1 CFH
Mitochondrion matrix 1 ALDH2
mitochondrial matrix 1 ALDH2
external side of plasma membrane 1 ANPEP
nucleolus 1 ZFX
Single-pass type II membrane protein 1 ANPEP
Mitochondrion inner membrane 1 CYP2E1
Peroxisome 1 ACOX1
peroxisomal matrix 1 ACOX1
peroxisomal membrane 1 ACOX1
chromatin 1 ZFX
Chromosome 1 ZFX
blood microparticle 1 CFH
Basolateral cell membrane 1 ABCC3
basal plasma membrane 1 ABCC3
secretory granule membrane 1 ANPEP
serine-type endopeptidase complex 1 CFH
Endoplasmic reticulum-Golgi intermediate compartment membrane 1 NAT8
[Isoform 2]: Cytoplasm 1 ADK
endoplasmic reticulum-Golgi intermediate compartment 2 ANPEP, NAT8
[Isoform 1]: Nucleus 1 ADK
Basal cell membrane 1 ABCC3
symbiont cell surface 1 CFH


文献列表

  • Sungkyoon Kim, Leonard B Collins, Gunnar Boysen, James A Swenberg, Avram Gold, Louise M Ball, Blair U Bradford, Ivan Rusyn. Liquid chromatography electrospray ionization tandem mass spectrometry analysis method for simultaneous detection of trichloroacetic acid, dichloroacetic acid, S-(1,2-dichlorovinyl)glutathione and S-(1,2-dichlorovinyl)-L-cysteine. Toxicology. 2009 Aug; 262(3):230-8. doi: 10.1016/j.tox.2009.06.013. [PMID: 19549554]
  • Edward A Lock, Jeremy L Barth, Scott W Argraves, Rick G Schnellmann. Changes in gene expression in human renal proximal tubule cells exposed to low concentrations of S-(1,2-dichlorovinyl)-l-cysteine, a metabolite of trichloroethylene. Toxicology and applied pharmacology. 2006 Oct; 216(2):319-30. doi: 10.1016/j.taap.2006.06.002. [PMID: 16844155]
  • Lawrence H Lash, David A Putt, Jean C Parker. Metabolism and tissue distribution of orally administered trichloroethylene in male and female rats: identification of glutathione- and cytochrome P-450-derived metabolites in liver, kidney, blood, and urine. Journal of toxicology and environmental health. Part A. 2006 Jul; 69(13):1285-309. doi: 10.1080/15287390500360133. [PMID: 16754541]
  • Trevor A McGoldrick, Edward A Lock, Vicente Rodilla, Gabrielle M Hawksworth. Renal cysteine conjugate C-S lyase mediated toxicity of halogenated alkenes in primary cultures of human and rat proximal tubular cells. Archives of toxicology. 2003 Jul; 77(7):365-70. doi: 10.1007/s00204-003-0459-6. [PMID: 12700887]
  • L H Lash, W Qian, D A Putt, S E Hueni, A A Elfarra, R J Krause, J C Parker. Renal and hepatic toxicity of trichloroethylene and its glutathione-derived metabolites in rats and mice: sex-, species-, and tissue-dependent differences. The Journal of pharmacology and experimental therapeutics. 2001 Apr; 297(1):155-64. doi: . [PMID: 11259540]
  • L H Lash, M W Anders. Cytotoxicity of S-(1,2-dichlorovinyl)glutathione and S-(1,2-dichlorovinyl)-L-cysteine in isolated rat kidney cells. The Journal of biological chemistry. 1986 Oct; 261(28):13076-81. doi: . [PMID: 2875994]


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