EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:28315 - alloxanthine

ChEBI IDCHEBI:28315
ChEBI Namealloxanthine
Stars
DefinitionA pyrazolopyrimidine that is 4,5,6,7-tetrahydro-H-pyrazolo[3,4-d]pyrimidine substituted by oxo groups at positions 4 and 6.
Secondary ChEBI IDsCHEBI:2603, CHEBI:22360
Last Modified23 October 2015
DownloadsMolfile
FormulaC5H4N4O2
Net Charge0
Average Mass152.113
Monoisotopic Mass152.03343
SMILESO=c1nc(=O)c2cnnc2n1
InChIInChI=1S/C5H4N4O2/c10-4-2-1-6-9-3(2)7-5(11)8-4/h1H,(H3,6,7,8,9,10,11)
InChIKeyHXNFUBHNUDHIGC-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
EC 1.17.3.2 (xanthine oxidase) inhibitor  An EC 1.17.3.* (oxidoreductase acting on CH or CH2 with oxygen as acceptor) inhibitor that interferes with the action of xanthine oxidase (EC 1.17.3.2).
ChEBI Ontology
Outgoing Relation(s)
alloxanthine (CHEBI:28315) has role drug metabolite (CHEBI:49103)
alloxanthine (CHEBI:28315) has role EC 1.17.3.2 (xanthine oxidase) inhibitor (CHEBI:35634)
alloxanthine (CHEBI:28315) is a pyrazolopyrimidine (CHEBI:38669)
Incoming Relation(s)
7-isobutyl-5-methyl-2-(1-naphthylmethyl)-3-(4-pyridyl)alloxanthine (CHEBI:39506) has functional parent alloxanthine (CHEBI:28315)
IUPAC Name 
1H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
Synonyms  Source
AlloxanthineKEGG COMPOUND
OxipurinolKEGG COMPOUND
OxoallopurinolChemIDplus
OxypurinolKEGG COMPOUND
Manual XrefsDatabases
2154BPDB
C07599KEGG COMPOUND
D02365KEGG DRUG
HMDB0000786HMDB
OxypurinolWikipedia
Registry NumbersSources
Reaxys:139956Reaxys
CAS:2465-59-0KEGG COMPOUND
CAS:2465-59-0ChemIDplus
Citations