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CHEBI:193231 - 8-C-Glucosyl-5-deoxykaempferol

ChEBI IDCHEBI:193231
ChEBI Name8-C-Glucosyl-5-deoxykaempferol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H20O10
Net Charge0
Average Mass432.381
Monoisotopic Mass432.10565
SMILES[H][C@@]1(c2c(O)ccc3c(=O)c(O)c(-c4ccc(O)cc4)oc23)OC(CO)[C@@H](O)[C@H](O)C1O
InChIInChI=1S/C21H20O10/c22-7-12-15(26)16(27)18(29)21(30-12)13-11(24)6-5-10-14(25)17(28)19(31-20(10)13)8-1-3-9(23)4-2-8/h1-6,12,15-16,18,21-24,26-29H,7H2/t12?,15-,16+,18?,21+/m1/s1
InChIKeyCCABFKLRHZCTBS-ZIRDDSNGSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
8-C-Glucosyl-5-deoxykaempferol (CHEBI:193231) is a C-glycosyl compound (CHEBI:20857)
8-C-Glucosyl-5-deoxykaempferol (CHEBI:193231) is a flavonoids (CHEBI:72544)
IUPAC Name 
3,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,4R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
Manual XrefsDatabases
24844337ChemSpider
LMPK12111547LIPID MAPS