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CHEBI:169244 - Aminofurantoin

ChEBI IDCHEBI:169244
ChEBI NameAminofurantoin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H8N4O3
Net Charge0
Average Mass208.177
Monoisotopic Mass208.05964
SMILESNc1ccc(/C=N/N2CC(=O)NC2=O)o1
InChIInChI=1S/C8H8N4O3/c9-6-2-1-5(15-6)3-10-12-4-7(13)11-8(12)14/h1-3H,4,9H2,(H,11,13,14)/b10-3+
InChIKeyKLJOOBXQOIHZQM-XCVCLJGOSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Aminofurantoin (CHEBI:169244) is a imidazolidine-2,4-dione (CHEBI:24628)
IUPAC Name 
1-[(E)-(5-aminouran-2-yl)methylideneamino]imidazolidine-2,4-dione
Manual XrefsDatabases
7851721ChemSpider
Registry NumbersSources
CAS:21997-21-7ChemIDplus