Difference between revisions of "CPD-676"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=2-METHYLACYL-COA-DEHYDROGENASE-RXN 2-METHYLACYL-COA-DEHYDROGENASE-RXN] == * direction: ** REVERSIBL...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-676 CPD-676] == * smiles: ** C([O-])(=O)C=CC1(C=C(O)C(O)=CC=1) * inchi key: ** InChIKey=QAI...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=2-METHYLACYL-COA-DEHYDROGENASE-RXN 2-METHYLACYL-COA-DEHYDROGENASE-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-676 CPD-676] ==
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* direction:
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* smiles:
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** REVERSIBLE
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** C([O-])(=O)C=CC1(C=C(O)C(O)=CC=1)
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* ec number:
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* inchi key:
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** [http://enzyme.expasy.org/EC/1.3.8.5 EC-1.3.8.5]
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** InChIKey=QAIPRVGONGVQAS-DUXPYHPUSA-M
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* common name:
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** trans-caffeate
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* molecular weight:
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** 179.152   
 
* Synonym(s):
 
* Synonym(s):
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** trans-caffeic acid
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** 3,4-dihydroxy-trans-cinnamate
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** (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid
  
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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-1126]]
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** 1 [[ETF-Oxidized]][c] '''+''' 1 [[PROTON]][c] '''+''' 1 [[2-METHYL-BUTYRYL-COA]][c] '''<=>''' 1 [[ETF-Reduced]][c] '''+''' 1 [[CPD-1083]][c]
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* [[RXN-1104]]
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* With common name(s):
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== Reaction(s) known to produce the compound ==
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** 1 an oxidized electron-transfer flavoprotein[c] '''+''' 1 H+[c] '''+''' 1 2-methylbutanoyl-CoA[c] '''<=>''' 1 a reduced electron-transfer flavoprotein[c] '''+''' 1 (E)-2-methylcrotonoyl-CoA[c]
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== Reaction(s) of unknown directionality ==
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== Genes associated with this reaction  ==
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== Pathways  ==
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* [[PWY-5109]], 2-methylbutanoate biosynthesis: [http://metacyc.org/META/NEW-IMAGE?object=PWY-5109 PWY-5109]
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** '''4''' reactions found over '''6''' reactions in the full pathway
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* [[ILEUDEG-PWY]], L-isoleucine degradation I: [http://metacyc.org/META/NEW-IMAGE?object=ILEUDEG-PWY ILEUDEG-PWY]
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** '''6''' reactions found over '''6''' reactions in the full pathway
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== Reconstruction information  ==
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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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* PUBCHEM:
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=43780 43780]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54691412 54691412]
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* LIGAND-RXN:
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* HMDB : HMDB03501
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** [http://www.genome.jp/dbget-bin/www_bget?R03169 R03169]
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* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?R03173 R03173]
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** [http://www.genome.jp/dbget-bin/www_bget?C01197 C01197]
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* UNIPROT:
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* CHEMSPIDER:
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** [http://www.uniprot.org/uniprot/Q08523 Q08523]
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** [http://www.chemspider.com/Chemical-Structure.4450294.html 4450294]
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{{#set: direction=REVERSIBLE}}
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* CHEBI:
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{{#set: ec number=EC-1.3.8.5}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57770 57770]
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{{#set: in pathway=PWY-5109|ILEUDEG-PWY}}
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* METABOLIGHTS : MTBLC57770
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{{#set: reconstruction category=annotation}}
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{{#set: smiles=C([O-])(=O)C=CC1(C=C(O)C(O)=CC=1)}}
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{{#set: reconstruction source=annotation-esiliculosus_genome}}
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{{#set: inchi key=InChIKey=QAIPRVGONGVQAS-DUXPYHPUSA-M}}
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: common name=trans-caffeate}}
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{{#set: molecular weight=179.152    }}
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{{#set: common name=trans-caffeic acid|3,4-dihydroxy-trans-cinnamate|(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid}}
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{{#set: consumed by=RXN-1126|RXN-1104}}

Latest revision as of 19:57, 21 March 2018

Metabolite CPD-676

  • smiles:
    • C([O-])(=O)C=CC1(C=C(O)C(O)=CC=1)
  • inchi key:
    • InChIKey=QAIPRVGONGVQAS-DUXPYHPUSA-M
  • common name:
    • trans-caffeate
  • molecular weight:
    • 179.152
  • Synonym(s):
    • trans-caffeic acid
    • 3,4-dihydroxy-trans-cinnamate
    • (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C([O-])(=O)C=CC1(C=C(O)C(O)=CC=1)" cannot be used as a page name in this wiki.



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