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CHEBI:62462 - isoguanine

ChEBI IDCHEBI:62462
ChEBI Nameisoguanine
Stars
DefinitionAn oxopurine that is 3,7-dihydro-purin-2-one in which the hydrogen at position 6 is substituted by an amino group.
Last Modified23 October 2015
SubmitterGareth Owen
DownloadsMolfile
FormulaC5H5N5O
Net Charge0
Average Mass151.129
Monoisotopic Mass151.04941
SMILESNc1nc(=O)nc2ncnc12
InChIInChI=1S/C5H5N5O/c6-3-2-4(8-1-7-2)10-5(11)9-3/h1H,(H4,6,7,8,9,10,11)
InChIKeyDRAVOWXCEBXPTN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
isoguanine (CHEBI:62462) is a oxopurine (CHEBI:25810)
IUPAC Name 
6-amino-3,7-dihydro-2H-purin-2-one
Synonyms  Source
6-amino-1,3-dihydro-2H-purin-2-oneChemIDplus
6-amino-3,7-dihydro-purin-2-oneChEBI
2-oxoadenineChEBI
2-hydroxyadenineChEBI
6-amino-3,9-dihydro-2H-purin-2-oneIUPAC
6-amino-9H-purin-2-olIUPAC
UniProt Name  Source
isoguanineUniProt
Registry NumbersSources
Reaxys:151787Reaxys
CAS:3373-53-3ChemIDplus
Citations