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CHEBI:184255 - Bavachinin

ChEBI IDCHEBI:184255
ChEBI NameBavachinin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O4
Net Charge0
Average Mass338.403
Monoisotopic Mass338.15181
SMILESCOc1cc2c(cc1CC=C(C)C)C(=O)C[C@@H](c1ccc(O)cc1)O2
InChIInChI=1S/C21H22O4/c1-13(2)4-5-15-10-17-18(23)11-20(14-6-8-16(22)9-7-14)25-21(17)12-19(15)24-3/h4,6-10,12,20,22H,5,11H2,1-3H3/t20-/m0/s1
InChIKeyVOCGSQHKPZSIKB-FQEVSTJZSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) serum (BTO:0001239) MetaboLights (MTBLS3725)
ChEBI Ontology
Outgoing Relation(s)
Bavachinin (CHEBI:184255) is a flavanones (CHEBI:28863)
IUPAC Name 
(2S)-2-(4-hydroxyphenyl)-7-methoxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
Manual XrefsDatabases
8512670ChemSpider
Registry NumbersSources
CAS:19879-30-2ChemIDplus