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CHEBI:180567 - 4-Chromanone

ChEBI IDCHEBI:180567
ChEBI Name4-Chromanone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H8O2
Net Charge0
Average Mass148.161
Monoisotopic Mass148.05243
SMILESO=C1CCOc2ccccc21
InChIInChI=1S/C9H8O2/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-4H,5-6H2
InChIKeyMSTDXOZUKAQDRL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) pancreas (BTO:0000988) MetaboLights (MTBLS1925) Strain: PANC-1 cell [BCGO:0000122]
Tricholoma imbricatum (ncbitaxon:54538) - PubMed (32534274)
ChEBI Ontology
Outgoing Relation(s)
4-Chromanone (CHEBI:180567) is a chromones (CHEBI:23238)
IUPAC Names 
2,3-dihydrochromen-4-one
methyl 3-[(2S)-7-hydroxy-2-methyl-4-oxo-3H-chromen-2-yl]propanoate
Manual XrefsDatabases
61418ChemSpider
Registry NumbersSources
CAS:491-37-2ChemIDplus