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CHEBI:229802 - 3-(4-hydroxy-3,5-dimethoxyphenyl)-1-(2,4,6-trihydroxy-3-methoxyphenyl)-1,2-propanedione

ChEBI IDCHEBI:229802
ChEBI Name3-(4-hydroxy-3,5-dimethoxyphenyl)-1-(2,4,6-trihydroxy-3-methoxyphenyl)-1,2-propanedione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H18O9
Net Charge0
Average Mass378.333
Monoisotopic Mass378.09508
SMILESCOc1cc(CC(=O)C(=O)c2c(O)cc(O)c(OC)c2O)cc(OC)c1O
InChIInChI=1S/C18H18O9/c1-25-12-5-8(6-13(26-2)16(12)23)4-10(20)15(22)14-9(19)7-11(21)18(27-3)17(14)24/h5-7,19,21,23-24H,4H2,1-3H3
InChIKeyKNBSSWIBPZEPOP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
3-(4-hydroxy-3,5-dimethoxyphenyl)-1-(2,4,6-trihydroxy-3-methoxyphenyl)-1,2-propanedione (CHEBI:229802) is a chalcones (CHEBI:23086)
IUPAC Name 
3-(4-hydroxy-3,5-dimethoxyphenyl)-1-(2,4,6-trihydroxy-3-methoxyphenyl)propane-1,2-dione
Manual XrefsDatabases
74852364ChemSpider