Difference between revisions of "CPD-479"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=5-OXOPROLINASE-ATP-HYDROLYSING-RXN 5-OXOPROLINASE-ATP-HYDROLYSING-RXN] == * direction: ** LEFT-TO-R...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-479 CPD-479] == * smiles: ** CSCCC(C([O-])=O)=O * inchi key: ** InChIKey=SXFSQZDSUWACKX-UHF...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=5-OXOPROLINASE-ATP-HYDROLYSING-RXN 5-OXOPROLINASE-ATP-HYDROLYSING-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-479 CPD-479] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CSCCC(C([O-])=O)=O
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* inchi key:
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** InChIKey=SXFSQZDSUWACKX-UHFFFAOYSA-M
 
* common name:
 
* common name:
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** 5-oxoprolinase (ATP-hydrolysing)
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** 2-oxo-4-methylthiobutanoate
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* ec number:
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* molecular weight:
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** [http://enzyme.expasy.org/EC/3.5.2.9 EC-3.5.2.9]
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** 147.168   
 
* Synonym(s):
 
* Synonym(s):
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** 2-keto-methyl-thio-butyrate
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** 2-keto-4-methylthiobutyrate
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** 4-methylthio-2-oxobutanoate
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** α-keto-4-methylthiobutyrate
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** 4-methylthio-2-ketobutyrate
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** 4-methylthio-2-ketobutanoate
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** 4-methylthio-2-oxobutyrate
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** 2-ketomethiobutyrate
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** KMTB
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** α-ketomethiobutyrate
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** 2-keto-4-methylthiobutyric acid
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** α-ketomethiobutyric acid
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** α-keto-γ-methylthiobutyrate
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** α-keto-γ-methylthiobutyric acid
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** 2-oxo-4-methylthiobutanoic acid
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** 2-oxomethionine
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** 2-keto-4-methylthiobutanoate
  
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== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
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* With identifiers:
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* [[RXN-12539]]
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** 1 [[5-OXOPROLINE]][c] '''+''' 1 [[ATP]][c] '''+''' 2 [[WATER]][c] '''=>''' 1 [[GLT]][c] '''+''' 1 [[PROTON]][c] '''+''' 1 [[ADP]][c] '''+''' 1 [[Pi]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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* [[R15-RXN-MET/P-HYDROXY-PHENYLPYRUVATE//CPD-479/TYR.42.]]
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** 1 5-oxo-L-proline[c] '''+''' 1 ATP[c] '''+''' 2 H2O[c] '''=>''' 1 L-glutamate[c] '''+''' 1 H+[c] '''+''' 1 ADP[c] '''+''' 1 phosphate[c]
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* [[R147-RXN]]
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== Reaction(s) of unknown directionality ==
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== Genes associated with this reaction  ==
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Genes have been associated with this reaction based on different elements listed below.
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* Gene: [[Ec-01_005550]]
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** Source: [[annotation-esiliculosus_genome]]
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*** Assignment: EC-NUMBER
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** Source: [[orthology-aragem]]
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== Pathways  ==
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* [[PWY-4041]], γ-glutamyl cycle: [http://metacyc.org/META/NEW-IMAGE?object=PWY-4041 PWY-4041]
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** '''5''' reactions found over '''6''' reactions in the full pathway
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== Reconstruction information  ==
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* Category: [[orthology]]
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** Source: [[orthology-aragem]]
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*** Tool: [[pantograph]]
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* Category: [[annotation]]
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** Source: [[annotation-esiliculosus_genome]]
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*** Tool: [[pathwaytools]]
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== External links  ==
 
== External links  ==
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* RHEA:
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* BIGG : 228408
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=10348 10348]
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* PUBCHEM:
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* LIGAND-RXN:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4584184 4584184]
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** [http://www.genome.jp/dbget-bin/www_bget?R00251 R00251]
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* HMDB : HMDB01553
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* UNIPROT:
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* LIGAND-CPD:
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** [http://www.uniprot.org/uniprot/P97608 P97608]
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** [http://www.genome.jp/dbget-bin/www_bget?C01180 C01180]
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{{#set: direction=LEFT-TO-RIGHT}}
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* CHEMSPIDER:
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{{#set: common name=5-oxoprolinase (ATP-hydrolysing)}}
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** [http://www.chemspider.com/Chemical-Structure.3776616.html 3776616]
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{{#set: ec number=EC-3.5.2.9}}
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* CHEBI:
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{{#set: gene associated=Ec-01_005550}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16723 16723]
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{{#set: in pathway=PWY-4041}}
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* METABOLIGHTS : MTBLC16723
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{{#set: reconstruction category=orthology|annotation}}
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{{#set: smiles=CSCCC(C([O-])=O)=O}}
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{{#set: reconstruction source=annotation-esiliculosus_genome|orthology-aragem}}
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{{#set: inchi key=InChIKey=SXFSQZDSUWACKX-UHFFFAOYSA-M}}
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{{#set: reconstruction tool=pantograph|pathwaytools}}
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{{#set: common name=2-oxo-4-methylthiobutanoate}}
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{{#set: molecular weight=147.168    }}
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{{#set: common name=2-keto-methyl-thio-butyrate|2-keto-4-methylthiobutyrate|4-methylthio-2-oxobutanoate|α-keto-4-methylthiobutyrate|4-methylthio-2-ketobutyrate|4-methylthio-2-ketobutanoate|4-methylthio-2-oxobutyrate|2-ketomethiobutyrate|KMTB|α-ketomethiobutyrate|2-keto-4-methylthiobutyric acid|α-ketomethiobutyric acid|α-keto-γ-methylthiobutyrate|α-keto-γ-methylthiobutyric acid|2-oxo-4-methylthiobutanoic acid|2-oxomethionine|2-keto-4-methylthiobutanoate}}
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{{#set: consumed by=RXN-12539}}
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{{#set: produced by=R15-RXN-MET/P-HYDROXY-PHENYLPYRUVATE//CPD-479/TYR.42.|R147-RXN}}

Latest revision as of 19:37, 21 March 2018

Metabolite CPD-479

  • smiles:
    • CSCCC(C([O-])=O)=O
  • inchi key:
    • InChIKey=SXFSQZDSUWACKX-UHFFFAOYSA-M
  • common name:
    • 2-oxo-4-methylthiobutanoate
  • molecular weight:
    • 147.168
  • Synonym(s):
    • 2-keto-methyl-thio-butyrate
    • 2-keto-4-methylthiobutyrate
    • 4-methylthio-2-oxobutanoate
    • α-keto-4-methylthiobutyrate
    • 4-methylthio-2-ketobutyrate
    • 4-methylthio-2-ketobutanoate
    • 4-methylthio-2-oxobutyrate
    • 2-ketomethiobutyrate
    • KMTB
    • α-ketomethiobutyrate
    • 2-keto-4-methylthiobutyric acid
    • α-ketomethiobutyric acid
    • α-keto-γ-methylthiobutyrate
    • α-keto-γ-methylthiobutyric acid
    • 2-oxo-4-methylthiobutanoic acid
    • 2-oxomethionine
    • 2-keto-4-methylthiobutanoate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • BIGG : 228408
  • PUBCHEM:
  • HMDB : HMDB01553
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC16723
"CSCCC(C([O-])=O)=O" cannot be used as a page name in this wiki.




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