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CHEBI:190032 - 2',4',6'-Trihydroxydihydrochalcone 4'-glucoside

ChEBI IDCHEBI:190032
ChEBI Name2',4',6'-Trihydroxydihydrochalcone 4'-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24O9
Net Charge0
Average Mass420.414
Monoisotopic Mass420.14203
SMILESO=C(CCc1ccccc1)c1c(O)cc(OC2OC(CO)C(O)C(O)C2O)cc1O
InChIInChI=1S/C21H24O9/c22-10-16-18(26)19(27)20(28)21(30-16)29-12-8-14(24)17(15(25)9-12)13(23)7-6-11-4-2-1-3-5-11/h1-5,8-9,16,18-22,24-28H,6-7,10H2
InChIKeyPDEJQNUGODFPTR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Brassica napus (ncbitaxon:3708) flower (BTO:0000469) MetaboLights (MTBLS3950)
ChEBI Ontology
Outgoing Relation(s)
2',4',6'-Trihydroxydihydrochalcone 4'-glucoside (CHEBI:190032) is a flavonoids (CHEBI:72544)
2',4',6'-Trihydroxydihydrochalcone 4'-glucoside (CHEBI:190032) is a glycoside (CHEBI:24400)
IUPAC Name 
1-[2,6-dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-phenylpropan-1-one
Manual XrefsDatabases
HMDB0037484HMDB