CHEBI:169943 - kaempferol 3-O-(6-O-malonyl-β-D-glucoside)(2−)

ChEBI IDCHEBI:169943
ChEBI Namekaempferol 3-O-(6-O-malonyl-β-D-glucoside)(2−)
Stars
ASCII Namekaempferol 3-O-(6-O-malonyl-beta-D-glucoside)(2-)
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC24H20O14
Net Charge-2
Average Mass532.410
Monoisotopic Mass532.08640
SMILESO=C([O-])CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc([O-])cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C24H22O14/c25-10-3-1-9(2-4-10)22-23(19(32)17-12(27)5-11(26)6-13(17)36-22)38-24-21(34)20(33)18(31)14(37-24)8-35-16(30)7-15(28)29/h1-6,14,18,20-21,24-27,31,33-34H,7-8H2,(H,28,29)/p-2/t14-,18-,20+,21-,24+/m1/s1
InChIKeyXEXCLTHHXIWUHO-UJKBSQBPSA-L
ChEBI Ontology
Outgoing Relation(s)
kaempferol 3-O-(6-O-malonyl-β-D-glucoside)(2−) (CHEBI:169943) is a flavonol 3-O-(6-O-malonyl-β-D-glucoside)(1−) (CHEBI:58034)
UniProt Name  Source
kaempferol 3-O-(6-O-malonyl-β-D-glucoside)UniProt
Manual XrefsDatabases
CPD-21600MetaCyc
Citations