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CHEBI:190118 - Retusin 7-Methyl Ether

Default Structure
ChEBI IDCHEBI:190118
ChEBI NameRetusin 7-Methyl Ether
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H14O5
Net Charge0
Average Mass298.294
Monoisotopic Mass298.08412
SMILESCOc1ccc(-c2coc3c(O)c(OC)ccc3c2=O)cc1
InChIInChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)13-9-22-17-12(15(13)18)7-8-14(21-2)16(17)19/h3-9,19H,1-2H3
InChIKeyRRCYPDDIDYVEIW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Brassica napus (ncbitaxon:3708) flower (BTO:0000469) MetaboLights (MTBLS3950)
ChEBI Ontology
Outgoing Relation(s)
Retusin 7-Methyl Ether (CHEBI:190118) is a methoxyisoflavone (CHEBI:38756)
IUPAC Name 
8-hydroxy-7-methoxy-3-(4-methoxyphenyl)chromen-4-one
Manual XrefsDatabases
5142791ChemSpider