Difference between revisions of "CARBOXYMETHYLENEBUTENOLIDASE-RXN"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12014 CPD-12014] == * smiles: ** CC(=O)NCCC1(=CNC2(C1=CC(OC)=C(O)C=2)) * common name: ** 6-...")
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=CARBOXYMETHYLENEBUTENOLIDASE-RXN CARBOXYMETHYLENEBUTENOLIDASE-RXN] == * direction: ** LEFT-TO-RIGHT...")
 
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[[Category:Metabolite]]
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[[Category:Reaction]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12014 CPD-12014] ==
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=CARBOXYMETHYLENEBUTENOLIDASE-RXN CARBOXYMETHYLENEBUTENOLIDASE-RXN] ==
* smiles:
+
* direction:
** CC(=O)NCCC1(=CNC2(C1=CC(OC)=C(O)C=2))
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** LEFT-TO-RIGHT
 
* common name:
 
* common name:
** 6-hydroxymelatonin
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** carboxymethylenebutenolidase
* inchi key:
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* ec number:
** InChIKey=OMYMRCXOJJZYKE-UHFFFAOYSA-N
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** [http://enzyme.expasy.org/EC/3.1.1.45 EC-3.1.1.45]
* molecular weight:
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** 248.281   
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* Synonym(s):
 
* Synonym(s):
  
== Reaction(s) known to consume the compound ==
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== Reaction Formula ==
* [[RXN-11058]]
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* With identifiers:
== Reaction(s) known to produce the compound ==
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** 1 [[WATER]][c] '''+''' 1 [[4-CARBOXYMETHYLENEBUT-2-EN-4-OLIDE]][c] '''=>''' 1 [[PROTON]][c] '''+''' 1 [[CPD-294]][c]
* [[RXN-11056]]
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* With common name(s):
== Reaction(s) of unknown directionality ==
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** 1 H2O[c] '''+''' 1 cis-dienelactone[c] '''=>''' 1 H+[c] '''+''' 1 2-maleylacetate[c]
 +
 
 +
== Genes associated with this reaction  ==
 +
Genes have been associated with this reaction based on different elements listed below.
 +
* Gene: [[Tiso_gene_12835]]
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** Source: [[annotation-in-silico_annotation]]
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*** Assignment: AUTOMATED-NAME-MATCH
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== Pathways  ==
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* [[PWY-6087]], 4-chlorocatechol degradation: [http://metacyc.org/META/NEW-IMAGE?object=PWY-6087 PWY-6087]
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** '''1''' reactions found over '''5''' reactions in the full pathway
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* [[PWY-6193]], 3-chlorocatechol degradation II (ortho): [http://metacyc.org/META/NEW-IMAGE?object=PWY-6193 PWY-6193]
 +
** '''1''' reactions found over '''5''' reactions in the full pathway
 +
== Reconstruction information  ==
 +
* Category: [[annotation]]
 +
** Source: [[annotation-in-silico_annotation]]
 +
*** Tool: [[pathwaytools]]
 
== External links  ==
 
== External links  ==
* PUBCHEM:
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* RHEA:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=1864 1864]
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=12372 12372]
* HMDB : HMDB04081
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* LIGAND-RXN:
* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?R03893 R03893]
** [http://www.genome.jp/dbget-bin/www_bget?C05643 C05643]
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* UNIPROT:
* CHEMSPIDER:
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** [http://www.uniprot.org/uniprot/P0A114 P0A114]
** [http://www.chemspider.com/Chemical-Structure.1794.html 1794]
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** [http://www.uniprot.org/uniprot/P27136 P27136]
* CHEBI:
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** [http://www.uniprot.org/uniprot/P27100 P27100]
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=2198 2198]
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** [http://www.uniprot.org/uniprot/P0A115 P0A115]
* METABOLIGHTS : MTBLC2198
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** [http://www.uniprot.org/uniprot/P73163 P73163]
{{#set: smiles=CC(=O)NCCC1(=CNC2(C1=CC(OC)=C(O)C=2))}}
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** [http://www.uniprot.org/uniprot/Q9RPF5 Q9RPF5]
{{#set: common name=6-hydroxymelatonin}}
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** [http://www.uniprot.org/uniprot/Q9RPB2 Q9RPB2]
{{#set: inchi key=InChIKey=OMYMRCXOJJZYKE-UHFFFAOYSA-N}}
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{{#set: direction=LEFT-TO-RIGHT}}
{{#set: molecular weight=248.281    }}
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{{#set: common name=carboxymethylenebutenolidase}}
{{#set: consumed by=RXN-11058}}
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{{#set: ec number=EC-3.1.1.45}}
{{#set: produced by=RXN-11056}}
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{{#set: gene associated=Tiso_gene_12835}}
 +
{{#set: in pathway=PWY-6087|PWY-6193}}
 +
{{#set: reconstruction category=annotation}}
 +
{{#set: reconstruction source=annotation-in-silico_annotation}}
 +
{{#set: reconstruction tool=pathwaytools}}

Latest revision as of 20:04, 21 March 2018

Reaction CARBOXYMETHYLENEBUTENOLIDASE-RXN

  • direction:
    • LEFT-TO-RIGHT
  • common name:
    • carboxymethylenebutenolidase
  • ec number:
  • Synonym(s):

Reaction Formula

Genes associated with this reaction

Genes have been associated with this reaction based on different elements listed below.

Pathways

  • PWY-6087, 4-chlorocatechol degradation: PWY-6087
    • 1 reactions found over 5 reactions in the full pathway
  • PWY-6193, 3-chlorocatechol degradation II (ortho): PWY-6193
    • 1 reactions found over 5 reactions in the full pathway

Reconstruction information

External links