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ChEBI
> Main
CHEBI:134104 - 8-oxoadenine
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ChEBI Ontology
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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.
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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
).
View more via ChEBI Ontology
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-8
H
-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
View more database links
Registry Numbers
Types
Sources
151789
Reaxys Registry Number
Reaxys
21149-26-8
CAS Registry Number
KNApSAcK
21149-26-8
CAS Registry Number
ChemIDplus
Citations
Types
Sources
10780366
PubMed citation
Europe PMC
11747549
PubMed citation
Europe PMC
12644468
PubMed citation
Europe PMC
12688418
PubMed citation
Europe PMC
15351402
PubMed citation
Europe PMC
1851559
PubMed citation
Europe PMC
21391900
PubMed citation
Europe PMC
23209024
PubMed citation
Europe PMC
23265901
PubMed citation
Europe PMC
24692658
PubMed citation
Europe PMC
25782998
PubMed citation
Europe PMC
26188111
PubMed citation
Europe PMC
26861551
PubMed citation
Europe PMC
2798767
PubMed citation
Europe PMC
8461291
PubMed citation
Europe PMC
8652548
PubMed citation
Europe PMC
9683192
PubMed citation
Europe PMC
Last Modified
11 November 2021