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CHEBI:190740 - 4-hydroxy-3-[1-(2-hydroxyphenyl)-3-oxobutyl]-2H-chromen-2-one

Default Structure
ChEBI IDCHEBI:190740
ChEBI Name4-hydroxy-3-[1-(2-hydroxyphenyl)-3-oxobutyl]-2H-chromen-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H16O5
Net Charge0
Average Mass324.332
Monoisotopic Mass324.09977
SMILESCC(=O)CC(c1ccccc1O)c1c(O)c2ccccc2oc1=O
InChIInChI=1S/C19H16O5/c1-11(20)10-14(12-6-2-4-8-15(12)21)17-18(22)13-7-3-5-9-16(13)24-19(17)23/h2-9,14,21-22H,10H2,1H3
InChIKeyWZDBFGYSJZMBIT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) root (BTO:0001188) MetaboLights (MTBLS4362)
ChEBI Ontology
Outgoing Relation(s)
4-hydroxy-3-[1-(2-hydroxyphenyl)-3-oxobutyl]-2H-chromen-2-one (CHEBI:190740) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name 
4-hydroxy-3-[1-(2-hydroxyphenyl)-3-oxobutyl]chromen-2-one
Manual XrefsDatabases
74854163ChemSpider
HMDB0140986HMDB