CHEBI:72574 - hypoxanthine 3-N-oxide

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ChEBI Name hypoxanthine 3-N-oxide
ChEBI ID CHEBI:72574
ChEBI ASCII Name hypoxanthine 3-N-oxide
Definition An oxopurine that is 3,9-dihydro-6H-purine which is substituted by an oxo group at position 6 and in which the hydrogen attached to the nitrogen at position 3 is replaced by a hydroxy group. It is a major component of Schreckstoff, an alarm pheromone found in fish.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C5H4N4O2
Net Charge 0
Average Mass 152.111
Monoisotopic Mass 152.03343
InChI InChI=1S/C5H4N4O2/c10-5-3-4(7-1-6-3)9(11)2-8-5/h1-2,11H,(H,6,7)
InChIKey RVVZOZMPKROZAR-UHFFFAOYSA-N
SMILES N1C2=C(N=C1)C(N=CN2O)=O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
alarm pheromone
A pheromone which is released by an organism when damaged by a predator which warns other individuals that there is a danger.
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ChEBI Ontology
Outgoing hypoxanthine 3-N-oxide (CHEBI:72574) has role alarm pheromone (CHEBI:72575)
hypoxanthine 3-N-oxide (CHEBI:72574) has role metabolite (CHEBI:25212)
hypoxanthine 3-N-oxide (CHEBI:72574) is a hydroxylamines (CHEBI:24709)
hypoxanthine 3-N-oxide (CHEBI:72574) is a oxopurine (CHEBI:25810)
hypoxanthine 3-N-oxide (CHEBI:72574) is a purine N-oxides (CHEBI:60341)
Incoming schreckstoff (CHEBI:133299) has part hypoxanthine 3-N-oxide (CHEBI:72574)
IUPAC Name
3-hydroxy-3,9-dihydro-6H-purin-6-one
Synonyms Sources
3-hydroxyhypoxanthine ChEBI
hypoxanthine 3-N-oxide ChEBI
hypoxanthine 3-oxide ChemIDplus
Registry Numbers Types Sources
19765-65-2 CAS Registry Number ChemIDplus
4992039 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
19583985 PubMed citation Europe PMC
22365850 PubMed citation Europe PMC
Last Modified
16 September 2016