Difference between revisions of "CPD-941"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=HYDROXYMETHYLGLUTARYL-COA-LYASE-RXN HYDROXYMETHYLGLUTARYL-COA-LYASE-RXN] == * direction: ** LEFT-TO...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-941 CPD-941] == * smiles: ** CCC(C(SCCC(CCCCC(N)=O)S)=O)C * common name: ** S-(2-methylbuta...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=HYDROXYMETHYLGLUTARYL-COA-LYASE-RXN HYDROXYMETHYLGLUTARYL-COA-LYASE-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-941 CPD-941] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CCC(C(SCCC(CCCCC(N)=O)S)=O)C
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* ec number:
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* common name:
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** [http://enzyme.expasy.org/EC/4.1.3.4 EC-4.1.3.4]
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** S-(2-methylbutanoyl)-dihydrolipoamide
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* inchi key:
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** InChIKey=UFNCWFSSEGPJNL-UHFFFAOYSA-N
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* molecular weight:
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** 291.466   
 
* Synonym(s):
 
* Synonym(s):
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** S-(2-methylbutyryl)dihydrolipoamide
  
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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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* [[DHRT_2mbcoa]]
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** 1 [[3-HYDROXY-3-METHYL-GLUTARYL-COA]][c] '''=>''' 1 [[ACETYL-COA]][c] '''+''' 1 [[3-KETOBUTYRATE]][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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** 1 (S)-3-hydroxy-3-methylglutaryl-CoA[c] '''=>''' 1 acetyl-CoA[c] '''+''' 1 acetoacetate[c]
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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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* [[Tiso_gene_3769]]
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** [[pantograph]]-[[athaliana]]
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** [[pantograph]]-[[esiliculosus]]
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== Pathways  ==
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* [[PWY66-367]], ketogenesis: [http://metacyc.org/META/NEW-IMAGE?object=PWY66-367 PWY66-367]
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** '''5''' reactions found over '''5''' reactions in the full pathway
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* [[LEU-DEG2-PWY]], L-leucine degradation I: [http://metacyc.org/META/NEW-IMAGE?object=LEU-DEG2-PWY LEU-DEG2-PWY]
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** '''6''' reactions found over '''6''' reactions in the full pathway
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* [[PWY-5074]], mevalonate degradation: [http://metacyc.org/META/NEW-IMAGE?object=PWY-5074 PWY-5074]
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** '''1''' reactions found over '''2''' reactions in the full pathway
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== Reconstruction information  ==
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* [[orthology]]:
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** [[pantograph]]:
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*** [[esiliculosus]]
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*** [[athaliana]]
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* [[annotation]]:
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** [[pathwaytools]]:
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*** [[experimental_annotation]]
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*** [[in-silico_annotation]]
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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=24404 24404]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=440565 440565]
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* LIGAND-RXN:
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* HMDB : HMDB06869
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** [http://www.genome.jp/dbget-bin/www_bget?R01360 R01360]
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* LIGAND-CPD:
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* UNIPROT:
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** [http://www.genome.jp/dbget-bin/www_bget?C05118 C05118]
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** [http://www.uniprot.org/uniprot/P35914 P35914]
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* CHEMSPIDER:
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** [http://www.uniprot.org/uniprot/P35915 P35915]
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** [http://www.chemspider.com/Chemical-Structure.389465.html 389465]
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** [http://www.uniprot.org/uniprot/Q8L7K2 Q8L7K2]
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* CHEBI:
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{{#set: direction=LEFT-TO-RIGHT}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28692 28692]
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{{#set: ec number=EC-4.1.3.4}}
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* METABOLIGHTS : MTBLC28692
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{{#set: gene associated=Tiso_gene_3769}}
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{{#set: smiles=CCC(C(SCCC(CCCCC(N)=O)S)=O)C}}
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{{#set: in pathway=PWY66-367|LEU-DEG2-PWY|PWY-5074}}
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{{#set: common name=S-(2-methylbutanoyl)-dihydrolipoamide}}
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{{#set: reconstruction category=orthology}}
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{{#set: inchi key=InChIKey=UFNCWFSSEGPJNL-UHFFFAOYSA-N}}
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{{#set: reconstruction tool=pantograph}}
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{{#set: molecular weight=291.466    }}
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{{#set: reconstruction source=esiliculosus|athaliana}}
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{{#set: common name=S-(2-methylbutyryl)dihydrolipoamide}}
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{{#set: reconstruction category=annotation}}
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{{#set: consumed by=DHRT_2mbcoa}}
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: reconstruction source=experimental_annotation|in-silico_annotation}}
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Latest revision as of 21:09, 21 March 2018

Metabolite CPD-941

  • smiles:
    • CCC(C(SCCC(CCCCC(N)=O)S)=O)C
  • common name:
    • S-(2-methylbutanoyl)-dihydrolipoamide
  • inchi key:
    • InChIKey=UFNCWFSSEGPJNL-UHFFFAOYSA-N
  • molecular weight:
    • 291.466
  • Synonym(s):
    • S-(2-methylbutyryl)dihydrolipoamide

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-941&oldid=46382"