Difference between revisions of "2-ACETO-2-HYDROXY-BUTYRATE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SCOPOLETIN SCOPOLETIN] == * smiles: ** COC2(C=C1(C(OC(=O)C=C1)=CC=2O)) * inchi key: ** InChIKey...")
 
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=1.11.1.12-RXN 1.11.1.12-RXN] == * direction: ** LEFT-TO-RIGHT * ec number: ** [http://enzyme.expasy...")
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[[Category:Metabolite]]
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[[Category:Reaction]]
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SCOPOLETIN SCOPOLETIN] ==
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=1.11.1.12-RXN 1.11.1.12-RXN] ==
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* smiles:
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* direction:
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** COC2(C=C1(C(OC(=O)C=C1)=CC=2O))
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** LEFT-TO-RIGHT
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* inchi key:
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* ec number:
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** InChIKey=RODXRVNMMDRFIK-UHFFFAOYSA-N
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** [http://enzyme.expasy.org/EC/1.11.1.12 EC-1.11.1.12]
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* common name:
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** scopoletin
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* molecular weight:
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** 192.171   
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* Synonym(s):
 
* Synonym(s):
  
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== Reaction(s) known to consume the compound ==
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== Reaction Formula ==
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== Reaction(s) known to produce the compound ==
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* With identifiers:
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* [[RXN-14179]]
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** 1 [[A-LIPID-HYDROPEROXIDE]][c] '''+''' 2 [[GLUTATHIONE]][c] '''=>''' 1 [[Lipid-hydroxy-fatty-acids]][c] '''+''' 1 [[OXIDIZED-GLUTATHIONE]][c] '''+''' 1 [[WATER]][c]
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== Reaction(s) of unknown directionality ==
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* With common name(s):
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** 1 a hydroperoxy-fatty-acyl-[lipid][c] '''+''' 2 glutathione[c] '''=>''' 1 a hydroxy-fatty-acyl-[lipid][c] '''+''' 1 glutathione disulfide[c] '''+''' 1 H2O[c]
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== Genes associated with this reaction  ==
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== Pathways  ==
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* [[PWY-4081]], glutathione-peroxide redox reactions: [http://metacyc.org/META/NEW-IMAGE?object=PWY-4081 PWY-4081]
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** '''3''' reactions found over '''3''' reactions in the full pathway
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== Reconstruction information  ==
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* [[annotation]]:
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** [[pathwaytools]]:
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*** [[experimental_annotation]]
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*** [[in-silico_annotation]]
 
== External links  ==
 
== External links  ==
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* NCI:
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* LIGAND-RXN:
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** [http://cactus.nci.nih.gov/ncidb2.2/?nsc=405647 405647]
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** [http://www.genome.jp/dbget-bin/www_bget?R03167 R03167]
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* PUBCHEM:
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* UNIPROT:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5280460 5280460]
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** [http://www.uniprot.org/uniprot/O23814 O23814]
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* HMDB : HMDB34344
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** [http://www.uniprot.org/uniprot/O48646 O48646]
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* LIGAND-CPD:
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{{#set: direction=LEFT-TO-RIGHT}}
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** [http://www.genome.jp/dbget-bin/www_bget?C01752 C01752]
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{{#set: ec number=EC-1.11.1.12}}
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* CHEMSPIDER:
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{{#set: in pathway=PWY-4081}}
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** [http://www.chemspider.com/Chemical-Structure.4444113.html 4444113]
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{{#set: reconstruction category=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=17488 17488]
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{{#set: reconstruction source=experimental_annotation|in-silico_annotation}}
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* METABOLIGHTS : MTBLC17488
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{{#set: smiles=COC2(C=C1(C(OC(=O)C=C1)=CC=2O))}}
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{{#set: inchi key=InChIKey=RODXRVNMMDRFIK-UHFFFAOYSA-N}}
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{{#set: common name=scopoletin}}
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{{#set: molecular weight=192.171    }}
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{{#set: produced by=RXN-14179}}
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Revision as of 16:54, 10 January 2018

Reaction 1.11.1.12-RXN

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

Reaction Formula

Genes associated with this reaction

Pathways

  • PWY-4081, glutathione-peroxide redox reactions: PWY-4081
    • 3 reactions found over 3 reactions in the full pathway

Reconstruction information

External links




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