Difference between revisions of "CPD-14425"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-7919 RXN-7919] == * direction: ** LEFT-TO-RIGHT * common name: ** hydroxyacylglutathione_hydrol...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14425 CPD-14425] == * smiles: ** CCC=CCC=CCC=CCC=CCC=CCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-7919 RXN-7919] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14425 CPD-14425] ==
* direction:
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* smiles:
** LEFT-TO-RIGHT
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** CCC=CCC=CCC=CCC=CCC=CCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]
 
* common name:
 
* common name:
** hydroxyacylglutathione_hydrolase
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** (2E,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-CoA
** hydroxyacyl_glutathione_hydrolase
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* inchi key:
* ec number:
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** InChIKey=HGVXUTAEZALTIG-HKHRKLHHSA-J
** [http://enzyme.expasy.org/EC/3.1.2.6 EC-3.1.2.6]
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* molecular weight:
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** 1073.981   
 
* Synonym(s):
 
* Synonym(s):
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** docosapentaenoyl-2-enoyl-CoA
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** (2E,7Z,10Z,13Z,16Z,19Z)-docosa-2,7,10,13,16,19-hexaenoyl-CoA
  
== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
* With identifiers:
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* [[RXN-13445]]
** 1 [[2-hydroxyacyl-glutathiones]][c] '''+''' 1 [[WATER]][c] '''=>''' 1 [[GLUTATHIONE]][c] '''+''' 1 [[2-Hydroxy-carboxylates]][c]
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== Reaction(s) known to produce the compound ==
* With common name(s):
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* [[RXN-13444]]
** 1 S-(2-hydroxyacyl)glutathione[c] '''+''' 1 H2O[c] '''=>''' 1 glutathione[c] '''+''' 1 a 2-hydroxy carboxylate[c]
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== Reaction(s) of unknown directionality ==
 
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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_10894]]
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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_10895]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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** [[pantograph]]-[[esiliculosus]]
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* [[Tiso_gene_5281]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_19886]]
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** IN-SILICO_ANNOTATION
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***AUTOMATED-NAME-MATCH
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== Pathways  ==
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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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* 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  ==
* LIGAND-RXN:
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* PUBCHEM:
** [http://www.genome.jp/dbget-bin/www_bget?R04090 R04090]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=72551532 72551532]
{{#set: direction=LEFT-TO-RIGHT}}
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* CHEBI:
{{#set: common name=hydroxyacylglutathione_hydrolase}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=76461 76461]
{{#set: common name=hydroxyacyl_glutathione_hydrolase}}
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{{#set: smiles=CCC=CCC=CCC=CCC=CCC=CCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]}}
{{#set: ec number=EC-3.1.2.6}}
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{{#set: common name=(2E,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-CoA}}
{{#set: gene associated=Tiso_gene_10894|Tiso_gene_10895|Tiso_gene_5281|Tiso_gene_19886}}
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{{#set: inchi key=InChIKey=HGVXUTAEZALTIG-HKHRKLHHSA-J}}
{{#set: in pathway=}}
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{{#set: molecular weight=1073.981    }}
{{#set: reconstruction category=orthology|annotation}}
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{{#set: common name=docosapentaenoyl-2-enoyl-CoA|(2E,7Z,10Z,13Z,16Z,19Z)-docosa-2,7,10,13,16,19-hexaenoyl-CoA}}
{{#set: reconstruction source=annotation-experimental_annotation|annotation-in-silico_annotation|orthology-esiliculosus}}
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{{#set: consumed by=RXN-13445}}
{{#set: reconstruction tool=pantograph|pathwaytools}}
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{{#set: produced by=RXN-13444}}

Latest revision as of 19:25, 21 March 2018

Metabolite CPD-14425

  • smiles:
    • CCC=CCC=CCC=CCC=CCC=CCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]
  • common name:
    • (2E,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-CoA
  • inchi key:
    • InChIKey=HGVXUTAEZALTIG-HKHRKLHHSA-J
  • molecular weight:
    • 1073.981
  • Synonym(s):
    • docosapentaenoyl-2-enoyl-CoA
    • (2E,7Z,10Z,13Z,16Z,19Z)-docosa-2,7,10,13,16,19-hexaenoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCC=CCC=CCC=CCC=CCC=CCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-" cannot be used as a page name in this wiki.