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CHEBI:168767 - 2-O-Acetylarbutin

Default Structure
ChEBI IDCHEBI:168767
ChEBI Name2-O-Acetylarbutin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O8
Net Charge0
Average Mass314.290
Monoisotopic Mass314.10017
SMILESCC(=O)OC1C(Oc2ccc(O)cc2)OC(CO)C(O)C1O
InChIInChI=1S/C14H18O8/c1-7(16)20-13-12(19)11(18)10(6-15)22-14(13)21-9-4-2-8(17)3-5-9/h2-5,10-15,17-19H,6H2,1H3
InChIKeyQLDACILJKOVPDG-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)
2-O-Acetylarbutin (CHEBI:168767) is a glycoside (CHEBI:24400)
IUPAC Name 
[4,5-dihydroxy-6-(hydroxymethyl)-2-(4-hydroxyphenoxy)oxan-3-yl] acetate
Manual XrefsDatabases
HMDB0040720HMDB