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CHEBI:168249 - L-Linalool 3-[xylosyl-(1->6)-glucoside]

ChEBI IDCHEBI:168249
ChEBI NameL-Linalool 3-[xylosyl-(1->6)-glucoside]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H36O10
Net Charge0
Average Mass448.509
Monoisotopic Mass448.23085
SMILESC=CC(C)(CCC=C(C)C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O
InChIInChI=1S/C21H36O10/c1-5-21(4,8-6-7-11(2)3)31-20-18(27)16(25)15(24)13(30-20)10-29-19-17(26)14(23)12(22)9-28-19/h5,7,12-20,22-27H,1,6,8-10H2,2-4H3
InChIKeyOKNPZRJNRSGKME-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)
L-Linalool 3-[xylosyl-(1->6)-glucoside] (CHEBI:168249) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
2-(3,7-dimethylocta-1,6-dien-3-yloxy)-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
Manual XrefsDatabases
HMDB0030421HMDB