prunetin-5-O-beta-D-glucuronide(1-) (CHEBI:147405)

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CHEBI:147405 - prunetin-5-O-β-D-glucuronide(1−)

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ChEBI ID	CHEBI:147405
ChEBI Name	prunetin-5-O-β-D-glucuronide(1−)
Stars
ASCII Name	prunetin-5-O-beta-D-glucuronide(1-)
Submitter	Kristian Axelsen
Downloads	Molfile

Formula	C22H19O11
Net Charge	-1
Average Mass	459.383
Monoisotopic Mass	459.09329
SMILES	COc1cc(O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)c2c(=O)c(-c3ccc(O)cc3)coc2c1
InChI	InChI=1S/C22H20O11/c1-30-11-6-13-15(16(24)12(8-31-13)9-2-4-10(23)5-3-9)14(7-11)32-22-19(27)17(25)18(26)20(33-22)21(28)29/h2-8,17-20,22-23,25-27H,1H3,(H,28,29)/p-1/t17-,18-,19+,20-,22+/m0/s1
InChIKey	CATNYWBROAUMSP-SXFAUFNYSA-M

ChEBI Ontology

Outgoing Relation(s)
	prunetin-5-O-β-D-glucuronide(1−) (CHEBI:147405) is a β-D-glucosiduronate (CHEBI:83411)

UniProt Name	Source
prunetin-5-O-β-D-glucuronide	UniProt

Citations