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CHEBI:187179 - 3,4,5-trihydroxy-6-[(8-hydroxy-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid

ChEBI IDCHEBI:187179
ChEBI Name3,4,5-trihydroxy-6-[(8-hydroxy-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H14O10
Net Charge0
Average Mass354.267
Monoisotopic Mass354.05870
SMILESO=C(O)C1OC(Oc2ccc3ccc(=O)oc3c2O)C(O)C(O)C1O
InChIInChI=1S/C15H14O10/c16-7-4-2-5-1-3-6(8(17)12(5)24-7)23-15-11(20)9(18)10(19)13(25-15)14(21)22/h1-4,9-11,13,15,17-20H,(H,21,22)
InChIKeyWDNFFLGXIZETEG-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)
3,4,5-trihydroxy-6-[(8-hydroxy-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid (CHEBI:187179) is a coumarins (CHEBI:23403)
3,4,5-trihydroxy-6-[(8-hydroxy-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid (CHEBI:187179) is a glycoside (CHEBI:24400)
IUPAC Name 
3,4,5-trihydroxy-6-(8-hydroxy-2-oxochromen-7-yl)oxyoxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0130552HMDB