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CHEBI:190806 - 4-hydroxy-3-(2-hydroxy-3-oxo-1-phenylbutyl)-2H-chromen-2-one

ChEBI IDCHEBI:190806
ChEBI Name4-hydroxy-3-(2-hydroxy-3-oxo-1-phenylbutyl)-2H-chromen-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H16O5
Net Charge0
Average Mass324.332
Monoisotopic Mass324.09977
SMILESCC(=O)C(O)C(c1ccccc1)c1c(O)c2ccccc2oc1=O
InChIInChI=1S/C19H16O5/c1-11(20)17(21)15(12-7-3-2-4-8-12)16-18(22)13-9-5-6-10-14(13)24-19(16)23/h2-10,15,17,21-22H,1H3
InChIKeyBPZSPAZBZFZZBN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) root (BTO:0001188) MetaboLights (MTBLS4362)
ChEBI Ontology
Outgoing Relation(s)
4-hydroxy-3-(2-hydroxy-3-oxo-1-phenylbutyl)-2H-chromen-2-one (CHEBI:190806) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name 
4-hydroxy-3-(2-hydroxy-3-oxo-1-phenylbutyl)chromen-2-one
Manual XrefsDatabases
HMDB0140992HMDB
19983904ChemSpider
Registry NumbersSources
CAS:83219-99-2ChemIDplus