Difference between revisions of "1-7-DIMETHYLXANTHINE"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=TRANS-RXN1HP7-9 TRANS-RXN1HP7-9] == * direction: ** LEFT-TO-RIGHT * common name: ** TRANS-RXN1HP7-9...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=1-7-DIMETHYLXANTHINE 1-7-DIMETHYLXANTHINE] == * smiles: ** CN2(C=NC1(=C(C(N(C(N1)=O)C)=O)2)) *...")
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=TRANS-RXN1HP7-9 TRANS-RXN1HP7-9] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=1-7-DIMETHYLXANTHINE 1-7-DIMETHYLXANTHINE] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CN2(C=NC1(=C(C(N(C(N1)=O)C)=O)2))
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* inchi key:
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** InChIKey=QUNWUDVFRNGTCO-UHFFFAOYSA-N
 
* common name:
 
* common name:
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** TRANS-RXN1HP7-9
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** paraxanthine
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* molecular weight:
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** 180.166   
 
* Synonym(s):
 
* Synonym(s):
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** 1,7-dimethylxanthine
  
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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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* [[RXN-11520]]
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** 1.0 [[FE+3]][e] '''+''' 1.0 [[PROTON]][e] '''=>''' 1.0 [[PROTON]][c] '''+''' 1.0 [[FE+3]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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** 1.0 Fe3+[e] '''+''' 1.0 H+[e] '''=>''' 1.0 H+[c] '''+''' 1.0 Fe3+[c]
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−
 
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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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* [[CHC_T00006111001_1]]
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** [[pantograph]]-[[galdieria.sulphuraria]]
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== Pathways  ==
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== Reconstruction information  ==
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* [[orthology]]:
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** [[pantograph]]:
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*** [[galdieria.sulphuraria]]
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== External links  ==
 
== External links  ==
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{{#set: direction=LEFT-TO-RIGHT}}
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* PUBCHEM:
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{{#set: common name=TRANS-RXN1HP7-9}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4687 4687]
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{{#set: gene associated=CHC_T00006111001_1}}
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* HMDB : HMDB01860
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{{#set: in pathway=}}
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* LIGAND-CPD:
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{{#set: reconstruction category=orthology}}
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** [http://www.genome.jp/dbget-bin/www_bget?C13747 C13747]
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{{#set: reconstruction tool=pantograph}}
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* CHEMSPIDER:
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{{#set: reconstruction source=galdieria.sulphuraria}}
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** [http://www.chemspider.com/Chemical-Structure.4525.html 4525]
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* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=25858 25858]
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* METABOLIGHTS : MTBLC25858
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{{#set: smiles=CN2(C=NC1(=C(C(N(C(N1)=O)C)=O)2))}}
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{{#set: inchi key=InChIKey=QUNWUDVFRNGTCO-UHFFFAOYSA-N}}
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{{#set: common name=paraxanthine}}
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{{#set: molecular weight=180.166    }}
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{{#set: common name=1,7-dimethylxanthine}}
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{{#set: consumed by=RXN-11520}}

Revision as of 16:20, 23 May 2018

Metabolite 1-7-DIMETHYLXANTHINE

  • smiles:
    • CN2(C=NC1(=C(C(N(C(N1)=O)C)=O)2))
  • inchi key:
    • InChIKey=QUNWUDVFRNGTCO-UHFFFAOYSA-N
  • common name:
    • paraxanthine
  • molecular weight:
    • 180.166
  • Synonym(s):
    • 1,7-dimethylxanthine

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • PUBCHEM:
  • HMDB : HMDB01860
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC25858




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