EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:175269 - Juglone glucoside

Default Structure
ChEBI IDCHEBI:175269
ChEBI NameJuglone glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O8
Net Charge0
Average Mass336.296
Monoisotopic Mass336.08452
SMILESO=C1C=CC(=O)c2c(OC3OC(CO)C(O)C(O)C3O)cccc21
InChIInChI=1S/C16H16O8/c17-6-11-13(20)14(21)15(22)16(24-11)23-10-3-1-2-7-8(18)4-5-9(19)12(7)10/h1-5,11,13-17,20-22H,6H2
InChIKeyAAYYJBZZHJNMEO-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Juglone glucoside (CHEBI:175269) is a glycoside (CHEBI:24400)
IUPAC Name 
5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalene-1,4-dione
Manual XrefsDatabases
HMDB0033563HMDB