Difference between revisions of "CPD-12482"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=3.1.6.12-RXN 3.1.6.12-RXN] == * direction: ** LEFT-TO-RIGHT * common name: ** arylsulfatase_b * ec...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12482 CPD-12482] == * smiles: ** CN1(C(=O)NC2(=C1C(=O)NC(=O)N(C)2)) * common name: ** 3,7-d...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=3.1.6.12-RXN 3.1.6.12-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12482 CPD-12482] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CN1(C(=O)NC2(=C1C(=O)NC(=O)N(C)2))
 
* common name:
 
* common name:
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** arylsulfatase_b
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** 3,7-dimethylurate
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* ec number:
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* inchi key:
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** [http://enzyme.expasy.org/EC/3.1.6.12 EC-3.1.6.12]
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** InChIKey=HMLZLHKHNBLLJD-UHFFFAOYSA-N
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* molecular weight:
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** 196.165   
 
* Synonym(s):
 
* Synonym(s):
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** 3,7-dimethyluric acid
  
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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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== Reaction(s) known to produce the compound ==
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** 1 [[WATER]][c] '''+''' 1 [[CHONDROITIN-4-SULFATE]][c] '''=>''' 1 [[Chondroitin-N-acetyl-galactosamines]][c] '''+''' 1 [[PROTON]][c] '''+''' 1 [[SULFATE]][c]
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* [[RXN-11519]]
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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** 1 H2O[c] '''+''' 1 [chondroitin]-4-O-sulfo-N-acetylgalactosamine[c] '''=>''' 1 [chondroitin]-N-acetyl-galactosamine[c] '''+''' 1 H+[c] '''+''' 1 sulfate[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_15619]]
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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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* [[annotation]]:
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** [[pathwaytools]]:
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*** [[in-silico_annotation]]
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== External links  ==
 
== External links  ==
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* UNIPROT:
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* PUBCHEM:
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** [http://www.uniprot.org/uniprot/P33727 P33727]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=83126 83126]
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** [http://www.uniprot.org/uniprot/P50430 P50430]
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* HMDB : HMDB01982
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** [http://www.uniprot.org/uniprot/P15848 P15848]
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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?C16360 C16360]
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{{#set: common name=arylsulfatase_b}}
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* CHEMSPIDER:
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{{#set: ec number=EC-3.1.6.12}}
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** [http://www.chemspider.com/Chemical-Structure.74994.html 74994]
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{{#set: gene associated=Tiso_gene_15619}}
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* CHEBI:
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{{#set: in pathway=}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=68531 68531]
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{{#set: reconstruction category=annotation}}
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* METABOLIGHTS : MTBLC68531
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: smiles=CN1(C(=O)NC2(=C1C(=O)NC(=O)N(C)2))}}
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{{#set: reconstruction source=in-silico_annotation}}
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{{#set: common name=3,7-dimethylurate}}
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{{#set: inchi key=InChIKey=HMLZLHKHNBLLJD-UHFFFAOYSA-N}}
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{{#set: molecular weight=196.165    }}
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{{#set: common name=3,7-dimethyluric acid}}
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{{#set: produced by=RXN-11519}}

Latest revision as of 19:08, 21 March 2018

Metabolite CPD-12482

  • smiles:
    • CN1(C(=O)NC2(=C1C(=O)NC(=O)N(C)2))
  • common name:
    • 3,7-dimethylurate
  • inchi key:
    • InChIKey=HMLZLHKHNBLLJD-UHFFFAOYSA-N
  • molecular weight:
    • 196.165
  • Synonym(s):
    • 3,7-dimethyluric acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • PUBCHEM:
  • HMDB : HMDB01982
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC68531




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