Difference between revisions of "XANTHINE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=XANTHINE XANTHINE] == * smiles: ** C12(NC(=O)NC(C=1N=CN2)=O) * inchi key: ** InChIKey=LRFVTYWOQ...")
 
 
Line 3: Line 3:
 
* smiles:
 
* smiles:
 
** C12(NC(=O)NC(C=1N=CN2)=O)
 
** C12(NC(=O)NC(C=1N=CN2)=O)
 +
* molecular weight:
 +
** 152.112   
 
* inchi key:
 
* inchi key:
 
** InChIKey=LRFVTYWOQMYALW-UHFFFAOYSA-N
 
** InChIKey=LRFVTYWOQMYALW-UHFFFAOYSA-N
 
* common name:
 
* common name:
 
** xanthine
 
** xanthine
* molecular weight:
 
** 152.112   
 
 
* Synonym(s):
 
* Synonym(s):
 
** 2,6-dioxopurine
 
** 2,6-dioxopurine
Line 20: Line 20:
 
* [[RXN0-901]]
 
* [[RXN0-901]]
 
== External links  ==
 
== External links  ==
* CAS : 69-89-6
 
 
* METABOLIGHTS : MTBLC17712
 
* METABOLIGHTS : MTBLC17712
* DRUGBANK : DB02134
+
* CAS : 69-89-6
* PUBCHEM:
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=1188 1188]
+
* HMDB : HMDB00292
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
 
** [http://www.genome.jp/dbget-bin/www_bget?C00385 C00385]
 
** [http://www.genome.jp/dbget-bin/www_bget?C00385 C00385]
 +
* HMDB : HMDB00292
 
* CHEMSPIDER:
 
* CHEMSPIDER:
 
** [http://www.chemspider.com/Chemical-Structure.1151.html 1151]
 
** [http://www.chemspider.com/Chemical-Structure.1151.html 1151]
 
* CHEBI:
 
* CHEBI:
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17712 17712]
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17712 17712]
 +
* DRUGBANK : DB02134
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=1188 1188]
 
* BIGG : xan
 
* BIGG : xan
 
{{#set: smiles=C12(NC(=O)NC(C=1N=CN2)=O)}}
 
{{#set: smiles=C12(NC(=O)NC(C=1N=CN2)=O)}}
 +
{{#set: molecular weight=152.112    }}
 
{{#set: inchi key=InChIKey=LRFVTYWOQMYALW-UHFFFAOYSA-N}}
 
{{#set: inchi key=InChIKey=LRFVTYWOQMYALW-UHFFFAOYSA-N}}
 
{{#set: common name=xanthine}}
 
{{#set: common name=xanthine}}
{{#set: molecular weight=152.112    }}
 
 
{{#set: common name=2,6-dioxopurine}}
 
{{#set: common name=2,6-dioxopurine}}
 
{{#set: consumed by=XANTHINE-OXIDASE-RXN|XANPRIBOSYLTRAN-RXN}}
 
{{#set: consumed by=XANTHINE-OXIDASE-RXN|XANPRIBOSYLTRAN-RXN}}
 
{{#set: produced by=RXN-7682}}
 
{{#set: produced by=RXN-7682}}
 
{{#set: reversible reaction associated=RXN0-901}}
 
{{#set: reversible reaction associated=RXN0-901}}

Latest revision as of 18:15, 9 January 2019

Metabolite XANTHINE

  • smiles:
    • C12(NC(=O)NC(C=1N=CN2)=O)
  • molecular weight:
    • 152.112
  • inchi key:
    • InChIKey=LRFVTYWOQMYALW-UHFFFAOYSA-N
  • common name:
    • xanthine
  • Synonym(s):
    • 2,6-dioxopurine

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • METABOLIGHTS : MTBLC17712
  • CAS : 69-89-6
  • LIGAND-CPD:
  • HMDB : HMDB00292
  • CHEMSPIDER:
  • CHEBI:
  • DRUGBANK : DB02134
  • PUBCHEM:
  • BIGG : xan