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CHEBI:190856 - 3,4,5-trihydroxy-6-{[2-(4-hydroxyphenyl)propanoyl]oxy}oxane-2-carboxylic acid

ChEBI IDCHEBI:190856
ChEBI Name3,4,5-trihydroxy-6-{[2-(4-hydroxyphenyl)propanoyl]oxy}oxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O9
Net Charge0
Average Mass342.300
Monoisotopic Mass342.09508
SMILESCC(C(=O)OC1OC(C(=O)O)C(O)C(O)C1O)c1ccc(O)cc1
InChIInChI=1S/C15H18O9/c1-6(7-2-4-8(16)5-3-7)14(22)24-15-11(19)9(17)10(18)12(23-15)13(20)21/h2-6,9-12,15-19H,1H3,(H,20,21)
InChIKeyVNZYZHRINANJBQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) root (BTO:0001188) MetaboLights (MTBLS4362)
ChEBI Ontology
Outgoing Relation(s)
3,4,5-trihydroxy-6-{[2-(4-hydroxyphenyl)propanoyl]oxy}oxane-2-carboxylic acid (CHEBI:190856) is a glucosiduronic acid (CHEBI:24302)
IUPAC Name 
3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)propanoyloxy]oxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0130015HMDB