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CHEBI:167969 - Phlorisobutyrophenone 2-glucoside

ChEBI IDCHEBI:167969
ChEBI NamePhlorisobutyrophenone 2-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H22O9
Net Charge0
Average Mass358.343
Monoisotopic Mass358.12638
SMILESCC(C)C(=O)c1c(O)cc(O)cc1OC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C16H22O9/c1-6(2)12(20)11-8(19)3-7(18)4-9(11)24-16-15(23)14(22)13(21)10(5-17)25-16/h3-4,6,10,13-19,21-23H,5H2,1-2H3
InChIKeyPSBKCHXAPMSDFN-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)
Phlorisobutyrophenone 2-glucoside (CHEBI:167969) is a glycoside (CHEBI:24400)
IUPAC Name 
1-[2,4-dihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2-methylpropan-1-one
Manual XrefsDatabases
HMDB0029651HMDB