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CHEBI:229190 - Pegamine

ChEBI IDCHEBI:229190
ChEBI NamePegamine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H12N2O2
Net Charge0
Average Mass204.229
Monoisotopic Mass204.08988
SMILESO=c1nc(CCCO)nc2ccccc12
InChIInChI=1S/C11H12N2O2/c14-7-3-6-10-12-9-5-2-1-4-8(9)11(15)13-10/h1-2,4-5,14H,3,6-7H2,(H,12,13,15)
InChIKeyPVVTWNMXEHROIA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
Pegamine (CHEBI:229190) is a quinazolines (CHEBI:38530)
IUPAC Name 
2-(3-hydroxypropyl)-3H-quinazolin-4-one
Manual XrefsDatabases
4885049ChemSpider