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CHEBI:168797 - Vanilloside

ChEBI IDCHEBI:168797
ChEBI NameVanilloside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O8
Net Charge0
Average Mass314.290
Monoisotopic Mass314.10017
SMILESCOc1cc(C=O)ccc1OC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C14H18O8/c1-20-9-4-7(5-15)2-3-8(9)21-14-13(19)12(18)11(17)10(6-16)22-14/h2-5,10-14,16-19H,6H2,1H3
InChIKeyLPRNQMUKVDHCFX-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)
Vanilloside (CHEBI:168797) is a glycoside (CHEBI:24400)
IUPAC Name 
3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzaldehyde
Manual XrefsDatabases
HMDB0029664HMDB
2882053ChemSpider