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CHEBI:184949 - 6-(3-carboxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

Default Structure
ChEBI IDCHEBI:184949
ChEBI Name6-(3-carboxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H14O9
Net Charge0
Average Mass314.246
Monoisotopic Mass314.06378
SMILESO=C(O)c1cccc(OC2OC(C(=O)O)C(O)C(O)C2O)c1
InChIInChI=1S/C13H14O9/c14-7-8(15)10(12(19)20)22-13(9(7)16)21-6-3-1-2-5(4-6)11(17)18/h1-4,7-10,13-16H,(H,17,18)(H,19,20)
InChIKeyZXNABXFYKZWAPQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
6-(3-carboxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid (CHEBI:184949) is a glycoside (CHEBI:24400)
IUPAC Name 
6-(3-carboxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0124994HMDB