Difference between revisions of "CPD0-1699"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=SULFITE-REDUCT-RXN SULFITE-REDUCT-RXN] == * direction: ** LEFT-TO-RIGHT * ec number: ** [http://enz...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8847 CPD-8847] == * smiles: ** C=CC(C)=O * common name: ** but-1-en-3-one * inchi key: ** I...")
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=SULFITE-REDUCT-RXN SULFITE-REDUCT-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8847 CPD-8847] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** C=CC(C)=O
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* ec number:
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* common name:
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** [http://enzyme.expasy.org/EC/1.8.1.2 EC-1.8.1.2]
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** but-1-en-3-one
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* inchi key:
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** InChIKey=FUSUHKVFWTUUBE-UHFFFAOYSA-N
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* molecular weight:
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** 70.091   
 
* Synonym(s):
 
* Synonym(s):
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** methyl vinyl ketone
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** 3-buten-2-one
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** 1-buten-3-one
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** but-3-en-2-one
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** 3-oxo-1-butene
  
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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-12293]]
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** 5 [[PROTON]][c] '''+''' 3 [[NADPH]][c] '''+''' 1 [[SO3]][c] '''=>''' 3 [[WATER]][c] '''+''' 3 [[NADP]][c] '''+''' 1 [[HS]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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* [[RXN-8619]]
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** 5 H+[c] '''+''' 3 NADPH[c] '''+''' 1 sulfite[c] '''=>''' 3 H2O[c] '''+''' 3 NADP+[c] '''+''' 1 hydrogen sulfide[c]
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* [[RXN-8620]]
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* [[RXN-11911]]
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== Genes associated with this reaction  ==
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== Reaction(s) of unknown directionality ==
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Genes have been associated with this reaction based on different elements listed below.
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* [[CHC_T00008333001_1]]
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** [[pantograph]]-[[galdieria.sulphuraria]]
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== Pathways  ==
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* [[SO4ASSIM-PWY]], sulfate reduction I (assimilatory): [http://metacyc.org/META/NEW-IMAGE?object=SO4ASSIM-PWY SO4ASSIM-PWY]
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** '''2''' reactions found over '''4''' reactions in the full pathway
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* [[PWY-6683]], sulfate reduction III (assimilatory): [http://metacyc.org/META/NEW-IMAGE?object=PWY-6683 PWY-6683]
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** '''2''' reactions found over '''3''' 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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*** [[galdieria.sulphuraria]]
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== External links  ==
 
== External links  ==
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* RHEA:
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* LIGAND-CPD:
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=13801 13801]
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** [http://www.genome.jp/dbget-bin/www_bget?C20701 C20701]
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* LIGAND-RXN:
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* CHEMSPIDER:
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** [http://www.genome.jp/dbget-bin/www_bget?R00858 R00858]
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** [http://www.chemspider.com/Chemical-Structure.6322.html 6322]
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* UNIPROT:
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* CHEBI:
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** [http://www.uniprot.org/uniprot/P38039 P38039]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=48058 48058]
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** [http://www.uniprot.org/uniprot/P17845 P17845]
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* PUBCHEM:
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** [http://www.uniprot.org/uniprot/Q9JUD9 Q9JUD9]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6570 6570]
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** [http://www.uniprot.org/uniprot/Q9JUD8 Q9JUD8]
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{{#set: smiles=C=CC(C)=O}}
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** [http://www.uniprot.org/uniprot/O32214 O32214]
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{{#set: common name=but-1-en-3-one}}
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** [http://www.uniprot.org/uniprot/P38038 P38038]
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{{#set: inchi key=InChIKey=FUSUHKVFWTUUBE-UHFFFAOYSA-N}}
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** [http://www.uniprot.org/uniprot/Q59396 Q59396]
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{{#set: molecular weight=70.091    }}
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** [http://www.uniprot.org/uniprot/P17846 P17846]
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{{#set: common name=methyl vinyl ketone|3-buten-2-one|1-buten-3-one|but-3-en-2-one|3-oxo-1-butene}}
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** [http://www.uniprot.org/uniprot/P52674 P52674]
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{{#set: consumed by=RXN-12293}}
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** [http://www.uniprot.org/uniprot/P39692 P39692]
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{{#set: produced by=RXN-8619|RXN-8620|RXN-11911}}
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{{#set: direction=LEFT-TO-RIGHT}}
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{{#set: ec number=EC-1.8.1.2}}
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{{#set: gene associated=CHC_T00008333001_1}}
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{{#set: in pathway=SO4ASSIM-PWY|PWY-6683}}
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{{#set: reconstruction category=orthology}}
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{{#set: reconstruction tool=pantograph}}
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{{#set: reconstruction source=galdieria.sulphuraria}}
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Revision as of 12:30, 18 January 2018

Metabolite CPD-8847

  • smiles:
    • C=CC(C)=O
  • common name:
    • but-1-en-3-one
  • inchi key:
    • InChIKey=FUSUHKVFWTUUBE-UHFFFAOYSA-N
  • molecular weight:
    • 70.091
  • Synonym(s):
    • methyl vinyl ketone
    • 3-buten-2-one
    • 1-buten-3-one
    • but-3-en-2-one
    • 3-oxo-1-butene

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links




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