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CHEBI:192126 - 3,4,5-trihydroxy-6-{[2-(3-hydroxyphenyl)acetyl]oxy}oxane-2-carboxylic acid

ChEBI IDCHEBI:192126
ChEBI Name3,4,5-trihydroxy-6-{[2-(3-hydroxyphenyl)acetyl]oxy}oxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H16O9
Net Charge0
Average Mass328.273
Monoisotopic Mass328.07943
SMILESO=C(Cc1cccc(O)c1)OC1OC(C(=O)O)C(O)C(O)C1O
InChIInChI=1S/C14H16O9/c15-7-3-1-2-6(4-7)5-8(16)22-14-11(19)9(17)10(18)12(23-14)13(20)21/h1-4,9-12,14-15,17-19H,5H2,(H,20,21)
InChIKeyIEDBQYRSZXEZNT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Marine plankton environmental sample (ncbitaxon:632957) - MetaboLights (MTBLS4424) Found in endometabolome.
ChEBI Ontology
Outgoing Relation(s)
3,4,5-trihydroxy-6-{[2-(3-hydroxyphenyl)acetyl]oxy}oxane-2-carboxylic acid (CHEBI:192126) is a glucosiduronic acid (CHEBI:24302)
IUPAC Name 
3,4,5-trihydroxy-6-[2-(3-hydroxyphenyl)acetyl]oxyoxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0125162HMDB