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CHEBI:174541 - Licochalcone A

ChEBI IDCHEBI:174541
ChEBI NameLicochalcone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O4
Net Charge0
Average Mass338.403
Monoisotopic Mass338.15181
SMILESC=CC(C)(C)c1cc(/C=C/C(=O)c2ccc(O)cc2)c(OC)cc1O
InChIInChI=1S/C21H22O4/c1-5-21(2,3)17-12-15(20(25-4)13-19(17)24)8-11-18(23)14-6-9-16(22)10-7-14/h5-13,22,24H,1H2,2-4H3/b11-8+
InChIKeyKAZSKMJFUPEHHW-DHZHZOJOSA-N
ChEBI Ontology
Outgoing Relation(s)
Licochalcone A (CHEBI:174541) is a chalcones (CHEBI:23086)
IUPAC Name 
(E)-3-[4-hydroxy-2-methoxy-5-(2-methylbut-3-en-2-yl)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one
Manual XrefsDatabases
LSM-44661LINCS
LMPK12120424LIPID MAPS
4477422ChemSpider
Registry NumbersSources
CAS:58749-22-7ChemIDplus