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CHEBI:229138 - Hexyl-beta-D-glucopyranosyl-(1--> 2)-beta-D-glucopyranoside

ChEBI IDCHEBI:229138
ChEBI NameHexyl-beta-D-glucopyranosyl-(1--> 2)-beta-D-glucopyranoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H34O11
Net Charge0
Average Mass426.459
Monoisotopic Mass426.21011
SMILESCCCCCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C18H34O11/c1-2-3-4-5-6-26-18-16(14(24)12(22)10(8-20)28-18)29-17-15(25)13(23)11(21)9(7-19)27-17/h9-25H,2-8H2,1H3/t9-,10-,11-,12+,13+,14+,15-,16-,17+,18-/m1/s1
InChIKeyXNWGHCFQUWCLDV-HWXDIYCWSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
Hexyl-beta-D-glucopyranosyl-(1--> 2)-beta-D-glucopyranoside (CHEBI:229138) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R,6R)-2-hexoxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol