Difference between revisions of "CPD-9923"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN0-5189 RXN0-5189] == * direction: ** LEFT-TO-RIGHT * common name: ** dna-3-methyladenine_glycosy...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-9923 CPD-9923] == * smiles: ** C1(=CC(O)C(C(=O)[O-])C(=C1)C(=O)CCC(=O)[O-]) * common name:...")
 
(One intermediate revision by the same user not shown)
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[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN0-5189 RXN0-5189] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-9923 CPD-9923] ==
* direction:
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* smiles:
** LEFT-TO-RIGHT
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** C1(=CC(O)C(C(=O)[O-])C(=C1)C(=O)CCC(=O)[O-])
 
* common name:
 
* common name:
** dna-3-methyladenine_glycosylase_i
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** (1R,6R)-6-hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate
** 3-methyladenine_dna_glycosylase
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* inchi key:
* ec number:
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** InChIKey=QJYRAJSESKVEAE-PSASIEDQSA-L
** [http://enzyme.expasy.org/EC/3.2.2.20 EC-3.2.2.20]
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* molecular weight:
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** 238.196   
 
* Synonym(s):
 
* Synonym(s):
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** SHCHC
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** (1R,6R)-2-succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate
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** 2-(3-CARBOXYPROPIONYL)-6-HYDROXY-CYCLOHEXA-2,4-DIENE CARBOXYLIC ACID
  
== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
* With identifiers:
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== Reaction(s) known to produce the compound ==
** 1 [[DNA-3-methyladenines]][c] '''+''' 1 [[WATER]][c] '''=>''' 1 [[DNA-containing-aPurinic-Sites]][c] '''+''' 1 [[3-Methyl-Adenines]][c]
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* [[RXN-9310]]
* With common name(s):
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== Reaction(s) of unknown directionality ==
** 1 an N3-methyladenine in DNA[c] '''+''' 1 H2O[c] '''=>''' 1 an apurinic site within DNA[c] '''+''' 1 3-methyladenine[c]
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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_7738]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_15814]]
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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-in-silico_annotation]]
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*** Tool: [[pathwaytools]]
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== External links  ==
 
== External links  ==
{{#set: direction=LEFT-TO-RIGHT}}
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* PUBCHEM:
{{#set: common name=dna-3-methyladenine_glycosylase_i}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25246102 25246102]
{{#set: common name=3-methyladenine_dna_glycosylase}}
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* CHEBI:
{{#set: ec number=EC-3.2.2.20}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58689 58689]
{{#set: gene associated=Tiso_gene_7738|Tiso_gene_15814}}
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* LIGAND-CPD:
{{#set: in pathway=}}
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** [http://www.genome.jp/dbget-bin/www_bget?C05817 C05817]
{{#set: reconstruction category=annotation}}
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{{#set: smiles=C1(=CC(O)C(C(=O)[O-])C(=C1)C(=O)CCC(=O)[O-])}}
{{#set: reconstruction source=annotation-in-silico_annotation}}
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{{#set: common name=(1R,6R)-6-hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate}}
{{#set: reconstruction tool=pathwaytools}}
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{{#set: inchi key=InChIKey=QJYRAJSESKVEAE-PSASIEDQSA-L}}
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{{#set: molecular weight=238.196    }}
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{{#set: common name=SHCHC|(1R,6R)-2-succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate|2-(3-CARBOXYPROPIONYL)-6-HYDROXY-CYCLOHEXA-2,4-DIENE CARBOXYLIC ACID}}
 +
{{#set: produced by=RXN-9310}}

Latest revision as of 21:18, 21 March 2018

Metabolite CPD-9923

  • smiles:
    • C1(=CC(O)C(C(=O)[O-])C(=C1)C(=O)CCC(=O)[O-])
  • common name:
    • (1R,6R)-6-hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate
  • inchi key:
    • InChIKey=QJYRAJSESKVEAE-PSASIEDQSA-L
  • molecular weight:
    • 238.196
  • Synonym(s):
    • SHCHC
    • (1R,6R)-2-succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate
    • 2-(3-CARBOXYPROPIONYL)-6-HYDROXY-CYCLOHEXA-2,4-DIENE CARBOXYLIC ACID

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C1(=CC(O)C(C(=O)[O-])C(=C1)C(=O)CCC(=O)[O-])" cannot be used as a page name in this wiki.