Difference between revisions of "ITACONATE"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=GLYCERALDEHYDE-DEHYDRO-RXN GLYCERALDEHYDE-DEHYDRO-RXN] == * direction: ** LEFT-TO-RIGHT * ec number...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ITACONATE ITACONATE] == * smiles: ** C=C(C(=O)[O-])CC([O-])=O * common name: ** itaconate * inc...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=GLYCERALDEHYDE-DEHYDRO-RXN GLYCERALDEHYDE-DEHYDRO-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ITACONATE ITACONATE] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** C=C(C(=O)[O-])CC([O-])=O
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* ec number:
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* common name:
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** [http://enzyme.expasy.org/EC/1.2.99.8 EC-1.2.99.8]
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** itaconate
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* inchi key:
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** InChIKey=LVHBHZANLOWSRM-UHFFFAOYSA-L
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* molecular weight:
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** 128.084   
 
* Synonym(s):
 
* Synonym(s):
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** propylenedicarboxylic acid
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** methylenebutanedioic acid
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** 2-propene-1,2-dicarboxylic acid
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** methylenesuccinic acid
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** itaconic acid
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** 2-methylsuccinate
  
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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-8988]]
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** 1 [[GLYCERALD]][c] '''+''' 1 [[Acceptor]][c] '''+''' 1 [[WATER]][c] '''=>''' 1 [[PROTON]][c] '''+''' 1 [[GLYCERATE]][c] '''+''' 1 [[Donor-H2]][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 D-glyceraldehyde[c] '''+''' 1 an oxidized electron acceptor[c] '''+''' 1 H2O[c] '''=>''' 1 H+[c] '''+''' 1 D-glycerate[c] '''+''' 1 a reduced electron acceptor[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_7322]]
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** [[pantograph]]-[[esiliculosus]]
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== Pathways  ==
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* [[NPGLUCAT-PWY]], Entner-Doudoroff pathway II (non-phosphorylative): [http://metacyc.org/META/NEW-IMAGE?object=NPGLUCAT-PWY NPGLUCAT-PWY]
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** '''4''' reactions found over '''9''' reactions in the full pathway
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== Reconstruction information  ==
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* Category: [[orthology]]
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** Source: [[orthology-esiliculosus]]
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*** Tool: [[pantograph]]
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== External links  ==
 
== External links  ==
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* RHEA:
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* CAS : 97-65-4
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=30783 30783]
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* PUBCHEM:
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* LIGAND-RXN:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5459996 5459996]
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** [http://www.genome.jp/dbget-bin/www_bget?R01752 R01752]
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* HMDB : HMDB02092
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{{#set: direction=LEFT-TO-RIGHT}}
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* LIGAND-CPD:
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{{#set: ec number=EC-1.2.99.8}}
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** [http://www.genome.jp/dbget-bin/www_bget?C00490 C00490]
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{{#set: gene associated=Tiso_gene_7322}}
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* CHEMSPIDER:
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{{#set: in pathway=NPGLUCAT-PWY}}
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** [http://www.chemspider.com/Chemical-Structure.4573697.html 4573697]
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{{#set: reconstruction category=orthology}}
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* CHEBI:
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{{#set: reconstruction source=orthology-esiliculosus}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17240 17240]
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{{#set: reconstruction tool=pantograph}}
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* METABOLIGHTS : MTBLC17240
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{{#set: smiles=C=C(C(=O)[O-])CC([O-])=O}}
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{{#set: common name=itaconate}}
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{{#set: inchi key=InChIKey=LVHBHZANLOWSRM-UHFFFAOYSA-L}}
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{{#set: molecular weight=128.084    }}
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{{#set: common name=propylenedicarboxylic acid|methylenebutanedioic acid|2-propene-1,2-dicarboxylic acid|methylenesuccinic acid|itaconic acid|2-methylsuccinate}}
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{{#set: consumed by=RXN-8988}}

Latest revision as of 19:52, 21 March 2018

Metabolite ITACONATE

  • smiles:
    • C=C(C(=O)[O-])CC([O-])=O
  • common name:
    • itaconate
  • inchi key:
    • InChIKey=LVHBHZANLOWSRM-UHFFFAOYSA-L
  • molecular weight:
    • 128.084
  • Synonym(s):
    • propylenedicarboxylic acid
    • methylenebutanedioic acid
    • 2-propene-1,2-dicarboxylic acid
    • methylenesuccinic acid
    • itaconic acid
    • 2-methylsuccinate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 97-65-4
  • PUBCHEM:
  • HMDB : HMDB02092
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC17240
"C=C(C(=O)[O-])CC([O-])=O" cannot be used as a page name in this wiki.



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