CHEBI:134104 - 8-oxoadenine

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ChEBI Name 8-oxoadenine
ChEBI ID CHEBI:134104
Definition A 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
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Formula C5H5N5O
Net Charge 0
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).
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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
Synonyms Sources
7,8-Dihydro-8-oxoadenine ChemIDplus
8-oxo-7,8-dihydroadenine HMDB
8-oxoA ChEBI
Oxyadenine HMDB
Manual Xrefs Databases
C00043227 KNApSAcK
HMDB0000542 HMDB
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Registry Numbers Types Sources
151789 Reaxys Registry Number Reaxys
21149-26-8 CAS Registry Number KNApSAcK
21149-26-8 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
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Last Modified
12 December 2016