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CHEBI:185456 - 6-[(5-acetyl-4-methoxy-1-benzofuran-6-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

ChEBI IDCHEBI:185456
ChEBI Name6-[(5-acetyl-4-methoxy-1-benzofuran-6-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H18O10
Net Charge0
Average Mass382.321
Monoisotopic Mass382.09000
SMILESCOc1c(C(C)=O)c(OC2OC(C(=O)O)C(O)C(O)C2O)cc2occc12
InChIInChI=1S/C17H18O10/c1-6(18)10-9(5-8-7(3-4-25-8)14(10)24-2)26-17-13(21)11(19)12(20)15(27-17)16(22)23/h3-5,11-13,15,17,19-21H,1-2H3,(H,22,23)
InChIKeyJEVQYACDJJDKGA-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-[(5-acetyl-4-methoxy-1-benzofuran-6-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CHEBI:185456) is a glycoside (CHEBI:24400)
IUPAC Name 
6-[(5-acetyl-4-methoxy-1-benzouran-6-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0129397HMDB