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CHEBI:168818 - Glucosylisomaltol

ChEBI IDCHEBI:168818
ChEBI NameGlucosylisomaltol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O8
Net Charge0
Average Mass288.252
Monoisotopic Mass288.08452
SMILESCC(=O)c1occc1OC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C12H16O8/c1-5(14)11-6(2-3-18-11)19-12-10(17)9(16)8(15)7(4-13)20-12/h2-3,7-10,12-13,15-17H,4H2,1H3
InChIKeyRRYYNIJTMYUJDC-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)
Glucosylisomaltol (CHEBI:168818) is a glycoside (CHEBI:24400)
IUPAC Name 
1-[3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyuran-2-yl]ethanone
Manual XrefsDatabases
HMDB0038341HMDB
8011309ChemSpider