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CHEBI:172642 - 5-Hydroxy-3,3',7,8-tetramethoxy-4',5'-methylenedioxyflavone

ChEBI IDCHEBI:172642
ChEBI Name5-Hydroxy-3,3',7,8-tetramethoxy-4',5'-methylenedioxyflavone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O9
Net Charge0
Average Mass402.355
Monoisotopic Mass402.09508
SMILESCOc1cc(-c2oc3c(OC)c(OC)cc(OC)c3c(=O)c2O)cc2c1OCO2
InChIInChI=1S/C20H18O9/c1-23-10-7-12(25-3)19(26-4)20-14(10)15(21)16(22)17(29-20)9-5-11(24-2)18-13(6-9)27-8-28-18/h5-7,22H,8H2,1-4H3
InChIKeyADHJMNNFIWLSBG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
5-Hydroxy-3,3',7,8-tetramethoxy-4',5'-methylenedioxyflavone (CHEBI:172642) is a hydroxyflavan (CHEBI:72010)
IUPAC Name 
3-hydroxy-5,7,8-trimethoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)chromen-4-one
Manual XrefsDatabases
30777546ChemSpider
HMDB0041257HMDB