CHEBI:190882 - 3,4,5-trihydroxy-6-{3-hydroxy-5-[2-(3-hydroxyphenyl)ethyl]phenoxy}oxane-2-carboxylic acid

ChEBI IDCHEBI:190882
ChEBI Name3,4,5-trihydroxy-6-{3-hydroxy-5-[2-(3-hydroxyphenyl)ethyl]phenoxy}oxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22O9
Net Charge0
Average Mass406.387
Monoisotopic Mass406.12638
SMILESO=C(O)C1OC(Oc2cc(O)cc(CCc3cccc(O)c3)c2)C(O)C(O)C1O
InChIInChI=1S/C20H22O9/c21-12-3-1-2-10(6-12)4-5-11-7-13(22)9-14(8-11)28-20-17(25)15(23)16(24)18(29-20)19(26)27/h1-3,6-9,15-18,20-25H,4-5H2,(H,26,27)
InChIKeyYRIGVZMZYJLQGA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) root (BTO:0001188) MetaboLights (MTBLS4362)
ChEBI Ontology
Outgoing Relation(s)
3,4,5-trihydroxy-6-{3-hydroxy-5-[2-(3-hydroxyphenyl)ethyl]phenoxy}oxane-2-carboxylic acid (CHEBI:190882) is a glycoside (CHEBI:24400)
3,4,5-trihydroxy-6-{3-hydroxy-5-[2-(3-hydroxyphenyl)ethyl]phenoxy}oxane-2-carboxylic acid (CHEBI:190882) is a stilbenoid (CHEBI:26776)
IUPAC Name 
3,4,5-trihydroxy-6-[3-hydroxy-5-[2-(3-hydroxyphenyl)ethyl]phenoxy]oxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0129949HMDB