Difference between revisions of "DIACETYL"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=2.3.1.118-RXN 2.3.1.118-RXN] == * direction: ** LEFT-TO-RIGHT * common name: ** arylamine_n-acetylt...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DIACETYL DIACETYL] == * smiles: ** CC(C(C)=O)=O * common name: ** diacetyl * inchi key: ** InCh...")
 
(3 intermediate revisions by the same user not shown)
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=2.3.1.118-RXN 2.3.1.118-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DIACETYL DIACETYL] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CC(C(C)=O)=O
 
* common name:
 
* common name:
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** arylamine_n-acetyltransferase
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** diacetyl
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* ec number:
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* inchi key:
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** [http://enzyme.expasy.org/EC/2.3.1.118 EC-2.3.1.118]
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** InChIKey=QSJXEFYPDANLFS-UHFFFAOYSA-N
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* molecular weight:
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** 86.09   
 
* Synonym(s):
 
* Synonym(s):
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** 2,3-butanedione
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** biacetyl
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** dimethylglyoxal
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** 2,3-diketobutane
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** 2,3-dioxobutane
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** butadione
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** dimethyl diketone
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** butanedione
  
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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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== Reaction(s) known to produce the compound ==
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** 1 [[ACETYL-COA]][c] '''+''' 1 [[N-Hydroxy-Arylamines]][c] '''=>''' 1 [[N-Acetoxy-Arylamines]][c] '''+''' 1 [[CO-A]][c]
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* [[RXN-6081]]
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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** 1 acetyl-CoA[c] '''+''' 1 an N-hydroxy-arylamine[c] '''=>''' 1 an N-acetoxyarylamine[c] '''+''' 1 coenzyme A[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_9942]]
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** IN-SILICO_ANNOTATION
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***AUTOMATED-NAME-MATCH
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** EXPERIMENTAL_ANNOTATION
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***AUTOMATED-NAME-MATCH
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== Pathways  ==
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== Reconstruction information  ==
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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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* LIGAND-RXN:
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* CAS : 431-03-8
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** [http://www.genome.jp/dbget-bin/www_bget?R08386 R08386]
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* PUBCHEM:
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* UNIPROT:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=650 650]
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** [http://www.uniprot.org/uniprot/Q00267 Q00267]
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* HMDB : HMDB03407
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** [http://www.uniprot.org/uniprot/P50292 P50292]
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* LIGAND-CPD:
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** [http://www.uniprot.org/uniprot/P77567 P77567]
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** [http://www.genome.jp/dbget-bin/www_bget?C00741 C00741]
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{{#set: direction=LEFT-TO-RIGHT}}
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* CHEMSPIDER:
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{{#set: common name=arylamine_n-acetyltransferase}}
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** [http://www.chemspider.com/Chemical-Structure.630.html 630]
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{{#set: ec number=EC-2.3.1.118}}
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* CHEBI:
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{{#set: gene associated=Tiso_gene_9942}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16583 16583]
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{{#set: in pathway=}}
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{{#set: smiles=CC(C(C)=O)=O}}
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{{#set: reconstruction category=annotation}}
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{{#set: common name=diacetyl}}
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: inchi key=InChIKey=QSJXEFYPDANLFS-UHFFFAOYSA-N}}
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{{#set: reconstruction source=experimental_annotation|in-silico_annotation}}
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{{#set: molecular weight=86.09    }}
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{{#set: common name=2,3-butanedione|biacetyl|dimethylglyoxal|2,3-diketobutane|2,3-dioxobutane|butadione|dimethyl diketone|butanedione}}
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{{#set: produced by=RXN-6081}}

Latest revision as of 20:46, 21 March 2018

Metabolite DIACETYL

  • smiles:
    • CC(C(C)=O)=O
  • common name:
    • diacetyl
  • inchi key:
    • InChIKey=QSJXEFYPDANLFS-UHFFFAOYSA-N
  • molecular weight:
    • 86.09
  • Synonym(s):
    • 2,3-butanedione
    • biacetyl
    • dimethylglyoxal
    • 2,3-diketobutane
    • 2,3-dioxobutane
    • butadione
    • dimethyl diketone
    • butanedione

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 431-03-8
  • PUBCHEM:
  • HMDB : HMDB03407
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:




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