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CHEBI:168717 - 2,6-Dimethyl-7-octene-1,6-diol 8-O-glucoside

ChEBI IDCHEBI:168717
ChEBI Name2,6-Dimethyl-7-octene-1,6-diol 8-O-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H30O7
Net Charge0
Average Mass334.409
Monoisotopic Mass334.19915
SMILESC=CC(C)(O)CCCC(C)COC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C16H30O7/c1-4-16(3,21)7-5-6-10(2)9-22-15-14(20)13(19)12(18)11(8-17)23-15/h4,10-15,17-21H,1,5-9H2,2-3H3
InChIKeyBTUZVFURXAOVBC-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)
2,6-Dimethyl-7-octene-1,6-diol 8-O-glucoside (CHEBI:168717) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
2-(6-hydroxy-2,6-dimethyloct-7-enoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
Manual XrefsDatabases
HMDB0033218HMDB