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CHEBI:190912 - 3-[2-(hydroxymethyl)-5-methoxy-2-methyl-2H-chromen-6-yl]-1-(4-hydroxyphenyl)propan-1-one

ChEBI IDCHEBI:190912
ChEBI Name3-[2-(hydroxymethyl)-5-methoxy-2-methyl-2H-chromen-6-yl]-1-(4-hydroxyphenyl)propan-1-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O5
Net Charge0
Average Mass354.402
Monoisotopic Mass354.14672
SMILESCOc1c(CCC(=O)c2ccc(O)cc2)ccc2c1C=CC(C)(CO)O2
InChIInChI=1S/C21H22O5/c1-21(13-22)12-11-17-19(26-21)10-6-15(20(17)25-2)5-9-18(24)14-3-7-16(23)8-4-14/h3-4,6-8,10-12,22-23H,5,9,13H2,1-2H3
InChIKeyUOZBWVITMGBQSR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) root (BTO:0001188) MetaboLights (MTBLS4362)
ChEBI Ontology
Outgoing Relation(s)
3-[2-(hydroxymethyl)-5-methoxy-2-methyl-2H-chromen-6-yl]-1-(4-hydroxyphenyl)propan-1-one (CHEBI:190912) is a dihydrochalcones (CHEBI:71230)
IUPAC Name 
3-[2-(hydroxymethyl)-5-methoxy-2-methylchromen-6-yl]-1-(4-hydroxyphenyl)propan-1-one
Manual XrefsDatabases
74851785ChemSpider
HMDB0125848HMDB