8-oxoadenine (CHEBI:134104)

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ChEBI Name	8-oxoadenine

ChEBI ID	CHEBI:134104

Definition	An oxopurine that is adenine bearing a single oxo substituent at position 8.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C5H5N5O

Net Charge

Average Mass

151.126

Monoisotopic Mass

151.04941

InChI

InChI=1S/C5H5N5O/c6-3-2-4(8-1-7-3)10-5(11)9-2/h1H,(H4,6,7,8,9,10,11)

InChIKey

RGKBRPAAQSHTED-UHFFFAOYSA-N

SMILES

C=12C(=NC=NC1N)NC(N2)=O

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	See: PubMed

Roles Classification
Biological Role(s):	human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).

ChEBI Ontology
Outgoing	8-oxoadenine (CHEBI:134104) has functional parent adenine (CHEBI:16708) 8-oxoadenine (CHEBI:134104) has role human metabolite (CHEBI:77746) 8-oxoadenine (CHEBI:134104) is a 6-aminopurines (CHEBI:20706) 8-oxoadenine (CHEBI:134104) is a nucleobase analogue (CHEBI:67142) 8-oxoadenine (CHEBI:134104) is a oxopurine (CHEBI:25810) 8-oxoadenine (CHEBI:134104) is tautomer of 8-hydroxyadenine (CHEBI:134105)

Incoming	8-hydroxyadenine (CHEBI:134105) is tautomer of 8-oxoadenine (CHEBI:134104)

IUPAC Name

6-amino-1,7-dihydro-8H-purin-8-one

Last Modified

11 November 2021