Difference between revisions of "ATCM"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3481 CPD-3481] == * smiles: ** CC([N+]C(C)(C)C)C(=O)C1(C=CC=C(Cl)C=1) * inchi key: ** InChI...")
 
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=R468-RXN R468-RXN] == * direction: ** LEFT-TO-RIGHT * common name: ** cyanuric_acid_amidohydrolase...")
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[[Category:Metabolite]]
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[[Category:Reaction]]
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3481 CPD-3481] ==
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=R468-RXN R468-RXN] ==
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* smiles:
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* direction:
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** CC([N+]C(C)(C)C)C(=O)C1(C=CC=C(Cl)C=1)
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** LEFT-TO-RIGHT
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* inchi key:
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** InChIKey=SNPPWIUOZRMYNY-UHFFFAOYSA-O
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* common name:
 
* common name:
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** bupropion
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** cyanuric_acid_amidohydrolase
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* molecular weight:
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* ec number:
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** 240.752   
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** [http://enzyme.expasy.org/EC/3.5.2.15 EC-3.5.2.15]
 
* Synonym(s):
 
* Synonym(s):
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** (-)-2-(tert-butylamino)-3'-chloropropiophenone
 
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** 1-propanone, 1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-,(+-)-
 
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** (+-)-1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-1-propanone
 
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** amfebutamonum
 
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** α-(tert-butylamino)-m-chloropropiophenone
 
  
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== Reaction(s) known to consume the compound ==
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== Reaction Formula ==
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* [[RXN66-181]]
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* With identifiers:
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== Reaction(s) known to produce the compound ==
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** 1 [[CYANURIC-ACID]][c] '''+''' 1 [[WATER]][c] '''=>''' 1 [[CARBON-DIOXIDE]][c] '''+''' 1 [[CPD-809]][c]
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== Reaction(s) of unknown directionality ==
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* With common name(s):
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** 1 cyanurate[c] '''+''' 1 H2O[c] '''=>''' 1 CO2[c] '''+''' 1 biuret[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_9325]]
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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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== Pathways  ==
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* [[PWY-5169]], cyanurate degradation: [http://metacyc.org/META/NEW-IMAGE?object=PWY-5169 PWY-5169]
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** '''1''' 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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* DRUGBANK : DB01156
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* RHEA:
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* PUBCHEM:
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=14641 14641]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=24849133 24849133]
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* LIGAND-RXN:
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* CHEBI:
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** [http://www.genome.jp/dbget-bin/www_bget?R07305 R07305]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=3219 3219]
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{{#set: direction=LEFT-TO-RIGHT}}
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* LIGAND-CPD:
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{{#set: common name=cyanuric_acid_amidohydrolase}}
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** [http://www.genome.jp/dbget-bin/www_bget?C06860 C06860]
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{{#set: ec number=EC-3.5.2.15}}
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* HMDB : HMDB01510
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{{#set: gene associated=Tiso_gene_9325}}
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{{#set: smiles=CC([N+]C(C)(C)C)C(=O)C1(C=CC=C(Cl)C=1)}}
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{{#set: in pathway=PWY-5169}}
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{{#set: inchi key=InChIKey=SNPPWIUOZRMYNY-UHFFFAOYSA-O}}
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{{#set: reconstruction category=annotation}}
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{{#set: common name=bupropion}}
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: molecular weight=240.752    }}
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{{#set: reconstruction source=experimental_annotation|in-silico_annotation}}
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{{#set: common name=(-)-2-(tert-butylamino)-3'-chloropropiophenone|1-propanone, 1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-,(+-)-|(+-)-1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-1-propanone|amfebutamonum|α-(tert-butylamino)-m-chloropropiophenone}}
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{{#set: consumed by=RXN66-181}}
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Revision as of 18:25, 10 January 2018

Reaction R468-RXN

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

Reaction Formula

Genes associated with this reaction

Genes have been associated with this reaction based on different elements listed below.

  • Tiso_gene_9325
    • IN-SILICO_ANNOTATION
      • EC-NUMBER
    • EXPERIMENTAL_ANNOTATION
      • EC-NUMBER

Pathways

  • PWY-5169, cyanurate degradation: PWY-5169
    • 1 reactions found over 3 reactions in the full pathway

Reconstruction information

External links





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