Difference between revisions of "CATECHOL"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=TRANS-RXN0-623 TRANS-RXN0-623] == * direction: ** LEFT-TO-RIGHT * common name: ** polyketide_syntha...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CATECHOL CATECHOL] == * smiles: ** C1(C=CC(=C(C=1)O)O) * common name: ** catechol * inchi key:...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=TRANS-RXN0-623 TRANS-RXN0-623] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CATECHOL CATECHOL] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** C1(C=CC(=C(C=1)O)O)
 
* common name:
 
* common name:
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** polyketide_synthase
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** catechol
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** long_chain_acyl-_synthetase
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* inchi key:
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** ORF
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** InChIKey=YCIMNLLNPGFGHC-UHFFFAOYSA-N
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** acyl-_synthetase
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* molecular weight:
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* ec number:
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** 110.112   
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** [http://enzyme.expasy.org/EC/6.2.1.3 EC-6.2.1.3]
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* Synonym(s):
 
* Synonym(s):
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** pyrocatechol
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** 2-hydroxyphenol
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** pyrocatechin
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** 1,2-dihydroxybenzene
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** 1,2-benzenediol
  
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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 [[CPD66-39]][e] '''+''' 1 [[PROTON]][e] '''+''' 1 [[CO-A]][c] '''+''' 1 [[ATP]][c] '''=>''' 1 [[PPI]][c] '''+''' 1 [[AMP]][c] '''+''' 1 [[Saturated-Fatty-Acyl-CoA]][c] '''+''' 1 [[PROTON]][c]
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* [[RXN-3661]]
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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** 1 a 2,3,4-saturated fatty acid[e] '''+''' 1 H+[e] '''+''' 1 coenzyme A[c] '''+''' 1 ATP[c] '''=>''' 1 diphosphate[c] '''+''' 1 AMP[c] '''+''' 1 a 2,3,4-saturated fatty acyl CoA[c] '''+''' 1 H+[c]
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* [[1.3.1.20-RXN]]
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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_13394]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_10876]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_7855]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_4191]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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** EXPERIMENTAL_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_500]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_136]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_348]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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** EXPERIMENTAL_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_9394]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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** EXPERIMENTAL_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_135]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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== Pathways  ==
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== Reconstruction information  ==
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* Category: [[annotation]]
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** Source: [[annotation-experimental_annotation]]
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*** Tool: [[pathwaytools]]
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** Source: [[annotation-in-silico_annotation]]
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*** Tool: [[pathwaytools]]
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== External links  ==
 
== External links  ==
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{{#set: direction=LEFT-TO-RIGHT}}
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* CAS : 120-80-9
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{{#set: common name=polyketide_synthase}}
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* DRUGBANK : DB02232
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{{#set: common name=long_chain_acyl-_synthetase}}
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* PUBCHEM:
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{{#set: common name=ORF}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=289 289]
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{{#set: common name=acyl-_synthetase}}
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* HMDB : HMDB00957
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{{#set: ec number=EC-6.2.1.3}}
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* LIGAND-CPD:
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{{#set: gene associated=Tiso_gene_13394|Tiso_gene_10876|Tiso_gene_7855|Tiso_gene_4191|Tiso_gene_500|Tiso_gene_136|Tiso_gene_348|Tiso_gene_9394|Tiso_gene_135}}
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** [http://www.genome.jp/dbget-bin/www_bget?C00090 C00090]
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{{#set: in pathway=}}
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* CHEMSPIDER:
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{{#set: reconstruction category=annotation}}
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** [http://www.chemspider.com/Chemical-Structure.13837760.html 13837760]
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{{#set: reconstruction source=annotation-experimental_annotation|annotation-in-silico_annotation}}
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* CHEBI:
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{{#set: reconstruction tool=pathwaytools}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18135 18135]
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* METABOLIGHTS : MTBLC18135
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{{#set: smiles=C1(C=CC(=C(C=1)O)O)}}
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{{#set: common name=catechol}}
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{{#set: inchi key=InChIKey=YCIMNLLNPGFGHC-UHFFFAOYSA-N}}
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{{#set: molecular weight=110.112    }}
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{{#set: common name=pyrocatechol|2-hydroxyphenol|pyrocatechin|1,2-dihydroxybenzene|1,2-benzenediol}}
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{{#set: produced by=RXN-3661}}
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{{#set: reversible reaction associated=1.3.1.20-RXN}}

Latest revision as of 19:06, 21 March 2018

Metabolite CATECHOL

  • smiles:
    • C1(C=CC(=C(C=1)O)O)
  • common name:
    • catechol
  • inchi key:
    • InChIKey=YCIMNLLNPGFGHC-UHFFFAOYSA-N
  • molecular weight:
    • 110.112
  • Synonym(s):
    • pyrocatechol
    • 2-hydroxyphenol
    • pyrocatechin
    • 1,2-dihydroxybenzene
    • 1,2-benzenediol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 120-80-9
  • DRUGBANK : DB02232
  • PUBCHEM:
  • HMDB : HMDB00957
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC18135




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