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CHEBI:167941 - 3'-Glucosyl-2',4',6'-trihydroxyacetophenone

ChEBI IDCHEBI:167941
ChEBI Name3'-Glucosyl-2',4',6'-trihydroxyacetophenone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O9
Net Charge0
Average Mass330.289
Monoisotopic Mass330.09508
SMILESCC(=O)c1c(O)cc(O)c(C2OC(CO)C(O)C(O)C2O)c1O
InChIInChI=1S/C14H18O9/c1-4(16)8-5(17)2-6(18)9(11(8)20)14-13(22)12(21)10(19)7(3-15)23-14/h2,7,10,12-15,17-22H,3H2,1H3
InChIKeyIWMUXTZLTOTAQO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
3'-Glucosyl-2',4',6'-trihydroxyacetophenone (CHEBI:167941) is a glycoside (CHEBI:24400)
IUPAC Name 
1-[2,4,6-trihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl]ethanone
Manual XrefsDatabases
HMDB0040621HMDB
35014975ChemSpider