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CHEBI:168568 - Neryl arabinofuranosyl-glucoside

ChEBI IDCHEBI:168568
ChEBI NameNeryl arabinofuranosyl-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H36O10
Net Charge0
Average Mass448.509
Monoisotopic Mass448.23085
SMILESCC(C)=CCC/C(C)=C\COC1OC(COC2OC(CO)C(O)C2O)C(O)C(O)C1O
InChIInChI=1S/C21H36O10/c1-11(2)5-4-6-12(3)7-8-28-20-19(27)17(25)16(24)14(31-20)10-29-21-18(26)15(23)13(9-22)30-21/h5,7,13-27H,4,6,8-10H2,1-3H3/b12-7-
InChIKeyAWDKYYYAAQQLEF-GHXNOFRVSA-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)
Neryl arabinofuranosyl-glucoside (CHEBI:168568) is a terpene glycoside (CHEBI:61777)
IUPAC Name 
2-[[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[(2Z)-3,7-dimethylocta-2,6-dienoxy]oxane-3,4,5-triol
Manual XrefsDatabases
HMDB0029348HMDB
13703054ChemSpider