Difference between revisions of "CPD-7036"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-8772 RXN-8772] == * direction: ** REVERSIBLE * common name: ** oxidoreductase ** aldo_keto_redu...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7036 CPD-7036] == * smiles: ** CSCCC=O * common name: ** 3-methylthiopropanal * inchi key:...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-8772 RXN-8772] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7036 CPD-7036] ==
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* direction:
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* smiles:
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** REVERSIBLE
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** CSCCC=O
 
* common name:
 
* common name:
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** oxidoreductase
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** 3-methylthiopropanal
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** aldo_keto_reductase
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* inchi key:
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** aldose_reductase
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** InChIKey=CLUWOWRTHNNBBU-UHFFFAOYSA-N
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* ec number:
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* molecular weight:
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** [http://enzyme.expasy.org/EC/1.1.1.21 EC-1.1.1.21]
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** 104.167   
 
* Synonym(s):
 
* Synonym(s):
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** methional
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** 3-methylthiopropional
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** 3-methylthio-propionaldehyde
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** 3-methylsulfanyl-propanal
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** 3-methylmercapto-propionaldehyde
  
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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-7706]]
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** 1 [[NADP]][c] '''+''' 1 [[L-ARABITOL]][c] '''<=>''' 1 [[PROTON]][c] '''+''' 1 [[L-arabinopyranose]][c] '''+''' 1 [[NADPH]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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**
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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: [[Tiso_gene_8988]]
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** Source: [[annotation-in-silico_annotation]]
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*** Assignment: EC-NUMBER
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* Gene: [[Tiso_gene_7799]]
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** Source: [[annotation-in-silico_annotation]]
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*** Assignment: AUTOMATED-NAME-MATCH
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* Gene: [[Tiso_gene_7800]]
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** Source: [[annotation-in-silico_annotation]]
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*** Assignment: AUTOMATED-NAME-MATCH
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* Gene: [[Tiso_gene_18748]]
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** Source: [[annotation-in-silico_annotation]]
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*** Assignment: EC-NUMBER
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== Pathways  ==
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* [[PWY-5515]], L-arabinose degradation II: [http://metacyc.org/META/NEW-IMAGE?object=PWY-5515 PWY-5515]
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** '''1''' reactions found over '''3''' reactions in the full pathway
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== Reconstruction information  ==
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* Category: [[annotation]]
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** Source: [[annotation-in-silico_annotation]]
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*** Tool: [[pathwaytools]]
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== External links  ==
 
== External links  ==
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* RHEA:
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* PUBCHEM:
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=25229 25229]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=18635 18635]
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* LIGAND-RXN:
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* CHEMSPIDER:
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** [http://www.genome.jp/dbget-bin/www_bget?R01759 R01759]
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** [http://www.chemspider.com/Chemical-Structure.17597.html 17597]
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{{#set: direction=REVERSIBLE}}
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* CHEBI:
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{{#set: common name=oxidoreductase}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=49017 49017]
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{{#set: common name=aldo_keto_reductase}}
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* HMDB : HMDB31857
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{{#set: common name=aldose_reductase}}
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{{#set: smiles=CSCCC=O}}
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{{#set: ec number=EC-1.1.1.21}}
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{{#set: common name=3-methylthiopropanal}}
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{{#set: gene associated=Tiso_gene_8988|Tiso_gene_7799|Tiso_gene_7800|Tiso_gene_18748}}
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{{#set: inchi key=InChIKey=CLUWOWRTHNNBBU-UHFFFAOYSA-N}}
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{{#set: in pathway=PWY-5515}}
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{{#set: molecular weight=104.167    }}
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{{#set: reconstruction category=annotation}}
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{{#set: common name=methional|3-methylthiopropional|3-methylthio-propionaldehyde|3-methylsulfanyl-propanal|3-methylmercapto-propionaldehyde}}
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{{#set: reconstruction source=annotation-in-silico_annotation}}
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{{#set: consumed by=RXN-7706}}
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{{#set: reconstruction tool=pathwaytools}}
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Latest revision as of 19:15, 21 March 2018

Metabolite CPD-7036

  • smiles:
    • CSCCC=O
  • common name:
    • 3-methylthiopropanal
  • inchi key:
    • InChIKey=CLUWOWRTHNNBBU-UHFFFAOYSA-N
  • molecular weight:
    • 104.167
  • Synonym(s):
    • methional
    • 3-methylthiopropional
    • 3-methylthio-propionaldehyde
    • 3-methylsulfanyl-propanal
    • 3-methylmercapto-propionaldehyde

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links




Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=CPD-7036&oldid=40418"