CHEBI:52617 - 7,8-dihydro-8-oxoguanine

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ChEBI Name 7,8-dihydro-8-oxoguanine
ChEBI ID CHEBI:52617
Definition An oxopurine that is guanine in which the hydrogen at position 8 is replaced by an oxo group and in which the nitrogens at positions 7 and 9 each bear a hydrogen.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C5H5N5O2
Net Charge 0
Average Mass 167.12550
Monoisotopic Mass 167.04432
InChI InChI=1S/C5H5N5O2/c6-4-8-2-1(3(11)10-4)7-5(12)9-2/h(H5,6,7,8,9,10,11,12)
InChIKey CLGFIVUFZRGQRP-UHFFFAOYSA-N
SMILES Nc1nc2[nH]c(=O)[nH]c2c(=O)[nH]1
ChEBI Ontology
Outgoing 7,8-dihydro-8-oxoguanine (CHEBI:52617) has functional parent guanine (CHEBI:16235)
7,8-dihydro-8-oxoguanine (CHEBI:52617) is a oxopurine (CHEBI:25810)
IUPAC Name
2-amino-7,9-dihydro-1H-purine-6,8-dione
Synonyms Sources
8-Hydroxyguanine ChEBI
8-oxoguanine UniProt
Registry Number Type Source
5614-64-2 CAS Registry Number ChemIDplus
Last Modified
23 October 2015