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CHEBI:187190 - 4-hydroxy-3-(3-hydroxy-1-phenylbutyl)-2H-chromen-2-one

ChEBI IDCHEBI:187190
ChEBI Name4-hydroxy-3-(3-hydroxy-1-phenylbutyl)-2H-chromen-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H18O4
Net Charge0
Average Mass310.349
Monoisotopic Mass310.12051
SMILESCC(O)CC(c1ccccc1)c1c(O)c2ccccc2oc1=O
InChIInChI=1S/C19H18O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,12,15,20-21H,11H2,1H3
InChIKeyZUJMMGHIYSAEOU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
4-hydroxy-3-(3-hydroxy-1-phenylbutyl)-2H-chromen-2-one (CHEBI:187190) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name 
4-hydroxy-3-(3-hydroxy-1-phenylbutyl)chromen-2-one
Manual XrefsDatabases
HMDB0140994HMDB
10533324ChemSpider
Registry NumbersSources
CAS:28392-96-3ChemIDplus