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CHEBI:192593 - 6-O-Isobutyryl-alpha-D-glucopyranosyl alpha-D-glucopyranoside

ChEBI IDCHEBI:192593
ChEBI Name6-O-Isobutyryl-alpha-D-glucopyranosyl alpha-D-glucopyranoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H28O12
Net Charge0
Average Mass412.388
Monoisotopic Mass412.15808
SMILESCC(C)C(=O)OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C16H28O12/c1-5(2)14(24)25-4-7-9(19)11(21)13(23)16(27-7)28-15-12(22)10(20)8(18)6(3-17)26-15/h5-13,15-23H,3-4H2,1-2H3/t6-,7-,8-,9-,10+,11+,12-,13-,15-,16-/m1/s1
InChIKeyFUUXIPLOLSVADM-MMEOWKKZSA-N
Species of MetaboliteComponentSourceComments
Valsa sordida (ncbitaxon:252740) Whole Organism (NCIT:C13413) MetaboLights (MTBLS4463)
ChEBI Ontology
Outgoing Relation(s)
6-O-Isobutyryl-alpha-D-glucopyranosyl alpha-D-glucopyranoside (CHEBI:192593) is a glycoside (CHEBI:24400)
IUPAC Name 
[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl 2-methylpropanoate
Manual XrefsDatabases
29814828ChemSpider