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CHEBI:172661 - 2',4',6'-Trihydroxydihydrochalcone 2'-glucoside

ChEBI IDCHEBI:172661
ChEBI Name2',4',6'-Trihydroxydihydrochalcone 2'-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24O9
Net Charge0
Average Mass420.414
Monoisotopic Mass420.14203
SMILESO=C(CCc1ccccc1)c1c(O)cc(O)cc1OC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C21H24O9/c22-10-16-18(26)19(27)20(28)21(30-16)29-15-9-12(23)8-14(25)17(15)13(24)7-6-11-4-2-1-3-5-11/h1-5,8-9,16,18-23,25-28H,6-7,10H2
InChIKeyNLGUKXQDDTZCDG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
2',4',6'-Trihydroxydihydrochalcone 2'-glucoside (CHEBI:172661) is a flavonoids (CHEBI:72544)
2',4',6'-Trihydroxydihydrochalcone 2'-glucoside (CHEBI:172661) is a glycoside (CHEBI:24400)
IUPAC Name 
1-[2,4-dihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-phenylpropan-1-one
Manual XrefsDatabases
HMDB0037483HMDB
4256839ChemSpider