CHEBI:179508 - Glucovanillin

ChEBI IDCHEBI:179508
ChEBI NameGlucovanillin
Stars
Last Modified1 June 2023
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O8
Net Charge0
Average Mass314.290
Monoisotopic Mass314.10017
SMILESCOc1cc(C=O)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
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/t10-,11-,12+,13-,14-/m1/s1
InChIKeyLPRNQMUKVDHCFX-RKQHYHRCSA-N
ChEBI Ontology
Outgoing Relation(s)
Glucovanillin (CHEBI:179508) is a glycoside (CHEBI:24400)
IUPAC Name 
3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzaldehyde
UniProt Name  Source
4-O-β-D-glucosyl-vanillinUniProt
Manual XrefsDatabases
C19808KEGG COMPOUND
4954574ChemSpider
Registry NumbersSources
CAS:494-08-6ChemIDplus