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CHEBI:131700 - quercetin-3'-glucuronide

ChEBI IDCHEBI:131700
ChEBI Namequercetin-3'-glucuronide
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Last Modified8 April 2016
Submittermwilliams
DownloadsMolfile
FormulaC21H20O13
Net Charge0
Average Mass480.378
Monoisotopic Mass480.09039
SMILESO=C1c2c(O)cc(O)cc2OC(c2ccc(O)c(OC3OC(C(=O)O)C(O)C(O)C3O)c2)C1O
InChIInChI=1S/C21H20O13/c22-7-4-9(24)12-11(5-7)32-18(15(27)13(12)25)6-1-2-8(23)10(3-6)33-21-17(29)14(26)16(28)19(34-21)20(30)31/h1-5,14-19,21-24,26-29H,(H,30,31)
InChIKeyHXJMVCQRRSNMPB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
quercetin-3'-glucuronide (CHEBI:131700) is a flavonoids (CHEBI:72544)
quercetin-3'-glucuronide (CHEBI:131700) is a β-D-glucosiduronic acid (CHEBI:15341)
Manual XrefsDatabases
HMDB0029213HMDB