CHEBI:58385 - luteolin 7-O-β-D-glucosiduronate

ChEBI IDCHEBI:58385
ChEBI Nameluteolin 7-O-β-D-glucosiduronate
Stars
ASCII Nameluteolin 7-O-beta-D-glucosiduronate
DefinitionA carbohydrate acid derivative anion that is the conjugate base of luteolin 7-O-β-D-glucosiduronic acid, arising from deprotonation of the carboxy group; major species at pH 7.3.
Last Modified17 April 2014
DownloadsMolfile
FormulaC21H17O12
Net Charge-1
Average Mass461.355
Monoisotopic Mass461.07255
SMILESO=C([O-])[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C21H18O12/c22-9-2-1-7(3-10(9)23)13-6-12(25)15-11(24)4-8(5-14(15)32-13)31-21-18(28)16(26)17(27)19(33-21)20(29)30/h1-6,16-19,21-24,26-28H,(H,29,30)/p-1/t16-,17-,18+,19-,21+/m0/s1
InChIKeyVSUOKLTVXQRUSG-ZFORQUDYSA-M
ChEBI Ontology
Outgoing Relation(s)
luteolin 7-O-β-D-glucosiduronate (CHEBI:58385) is a carbohydrate acid derivative anion (CHEBI:63551)
luteolin 7-O-β-D-glucosiduronate (CHEBI:58385) is a monocarboxylic acid anion (CHEBI:35757)
luteolin 7-O-β-D-glucosiduronate (CHEBI:58385) is conjugate acid of luteolin 7-O-β-D-glucosiduronate(2−) (CHEBI:77671)
luteolin 7-O-β-D-glucosiduronate (CHEBI:58385) is conjugate base of luteolin 7-O-β-D-glucosiduronic acid (CHEBI:18128)
Incoming Relation(s)
luteolin 7-O-β-D-glucosiduronic acid (CHEBI:18128) is conjugate acid of luteolin 7-O-β-D-glucosiduronate (CHEBI:58385)
luteolin 7-O-β-D-glucosiduronate(2−) (CHEBI:77671) is conjugate base of luteolin 7-O-β-D-glucosiduronate (CHEBI:58385)
IUPAC Name 
2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl β-D-glucopyranosiduronate
Synonyms  Source
luteolin 7-O-β-D-glucosiduronate(1−)ChEBI
luteolin 7-O-β-D-glucosiduronate anionChEBI
Manual XrefsDatabases
LUTEOLIN-7-O-BETA-D-GLUCURONIDEMetaCyc