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CHEBI:167984 - Linalool oxide D 3-[apiosyl-(1->6)-glucoside]

ChEBI IDCHEBI:167984
ChEBI NameLinalool oxide D 3-[apiosyl-(1->6)-glucoside]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H36O11
Net Charge0
Average Mass464.508
Monoisotopic Mass464.22576
SMILESC=CC1(C)CCC(OC2OC(COC3OCC(O)(CO)C3O)C(O)C(O)C2O)C(C)(C)O1
InChIInChI=1S/C21H36O11/c1-5-20(4)7-6-12(19(2,3)32-20)31-17-15(25)14(24)13(23)11(30-17)8-28-18-16(26)21(27,9-22)10-29-18/h5,11-18,22-27H,1,6-10H2,2-4H3
InChIKeyAINNVCLTLJOODL-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)
Linalool oxide D 3-[apiosyl-(1->6)-glucoside] (CHEBI:167984) is a glycoside (CHEBI:24400)
IUPAC Name 
2-[[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-(6-ethenyl-2,2,6-trimethyloxan-3-yl)oxyoxane-3,4,5-triol
Manual XrefsDatabases
HMDB0031367HMDB