Difference between revisions of "ACETOACETYL-COA"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14771 RXN-14771] == * direction: ** LEFT-TO-RIGHT * common name: ** acyl-CoA oxidase, partial *...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACETOACETYL-COA ACETOACETYL-COA] == * smiles: ** CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O...")
 
(One intermediate revision by the same user not shown)
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14771 RXN-14771] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACETOACETYL-COA ACETOACETYL-COA] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CC(=O)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-]
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* inchi key:
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** InChIKey=OJFDKHTZOUZBOS-CITAKDKDSA-J
 
* common name:
 
* common name:
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** acyl-CoA oxidase, partial
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** acetoacetyl-CoA
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** Acyl-CoA oxidase/dehydrogenase, central domain
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* molecular weight:
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** acyl-CoA oxidase
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** 847.577   
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* ec number:
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** [http://enzyme.expasy.org/EC/1.3.3.6 EC-1.3.3.6]
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* Synonym(s):
 
* Synonym(s):
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** 3-acetoacetyl-CoA
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** acetoacetyl-S-CoA
  
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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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* [[3-HYDROXYBUTYRYL-COA-DEHYDROGENASE-RXN]]
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** 1 [[OXYGEN-MOLECULE]][c] '''+''' 1 [[CPD-15637]][c] '''=>''' 1 [[HYDROGEN-PEROXIDE]][c] '''+''' 1 [[CPD-15666]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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* [[ACETOACETATE--COA-LIGASE-RXN]]
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** 1 oxygen[c] '''+''' 1 6-cis-tridecenoyl-CoA[c] '''=>''' 1 hydrogen peroxide[c] '''+''' 1 6-cis, 2-trans-tridecadienoyl-CoA[c]
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== Reaction(s) of unknown directionality ==
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* [[RXN-11662]]
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== Genes associated with this reaction  ==
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* [[HYDROXYMETHYLGLUTARYL-COA-SYNTHASE-RXN]]
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Genes have been associated with this reaction based on different elements listed below.
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* [[ACETYL-COA-ACETYLTRANSFER-RXN]]
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* [[Ec-26_004320]]
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** ESILICULOSUS_GENOME
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***EC-NUMBER
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* [[Ec-08_006390]]
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** ESILICULOSUS_GENOME
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***AUTOMATED-NAME-MATCH
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* [[Ec-22_002920]]
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** ESILICULOSUS_GENOME
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***EC-NUMBER
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== Pathways  ==
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* [[PWY-7337]], 10-cis-heptadecenoyl-CoA degradation (yeast): [http://metacyc.org/META/NEW-IMAGE?object=PWY-7337 PWY-7337]
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** '''3''' reactions found over '''12''' reactions in the full pathway
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== Reconstruction information  ==
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* Category: [[annotation]]
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** Source: [[annotation-esiliculosus_genome]]
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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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* DRUGBANK : DB03059
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{{#set: common name=acyl-CoA oxidase, partial}}
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* CAS : 1420-36-6
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{{#set: common name=Acyl-CoA oxidase/dehydrogenase, central domain}}
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* BIGG : 34646
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{{#set: common name=acyl-CoA oxidase}}
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* LIPID_MAPS : LMFA07050030
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{{#set: ec number=EC-1.3.3.6}}
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* PUBCHEM:
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{{#set: gene associated=Ec-26_004320|Ec-08_006390|Ec-22_002920}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45266540 45266540]
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{{#set: in pathway=PWY-7337}}
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* KNAPSACK : C00007269
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{{#set: reconstruction category=annotation}}
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* HMDB : HMDB01484
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{{#set: reconstruction source=annotation-esiliculosus_genome}}
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* LIGAND-CPD:
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{{#set: reconstruction tool=pathwaytools}}
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** [http://www.genome.jp/dbget-bin/www_bget?C00332 C00332]
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* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57286 57286]
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* METABOLIGHTS : MTBLC57286
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{{#set: smiles=CC(=O)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: inchi key=InChIKey=OJFDKHTZOUZBOS-CITAKDKDSA-J}}
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{{#set: common name=acetoacetyl-CoA}}
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{{#set: molecular weight=847.577    }}
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{{#set: common name=3-acetoacetyl-CoA|acetoacetyl-S-CoA}}
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{{#set: consumed by=3-HYDROXYBUTYRYL-COA-DEHYDROGENASE-RXN}}
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{{#set: produced by=ACETOACETATE--COA-LIGASE-RXN}}
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{{#set: reversible reaction associated=RXN-11662|HYDROXYMETHYLGLUTARYL-COA-SYNTHASE-RXN|ACETYL-COA-ACETYLTRANSFER-RXN}}

Latest revision as of 19:33, 21 March 2018

Metabolite ACETOACETYL-COA

  • smiles:
    • CC(=O)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-]
  • inchi key:
    • InChIKey=OJFDKHTZOUZBOS-CITAKDKDSA-J
  • common name:
    • acetoacetyl-CoA
  • molecular weight:
    • 847.577
  • Synonym(s):
    • 3-acetoacetyl-CoA
    • acetoacetyl-S-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • DRUGBANK : DB03059
  • CAS : 1420-36-6
  • BIGG : 34646
  • LIPID_MAPS : LMFA07050030
  • PUBCHEM:
  • KNAPSACK : C00007269
  • HMDB : HMDB01484
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC57286
"CC(=O)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.




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