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CHEBI:185476 - 5,7,3',4'-Tetrahydroxy-6-C-methylflavanone 7-O-glucoside

ChEBI IDCHEBI:185476
ChEBI Name5,7,3',4'-Tetrahydroxy-6-C-methylflavanone 7-O-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H24O11
Net Charge0
Average Mass464.423
Monoisotopic Mass464.13186
SMILESCc1c(OC2OC(CO)C(O)C(O)C2O)cc2c(c1O)C(=O)CC(c1ccc(O)c(O)c1)O2
InChIInChI=1S/C22H24O11/c1-8-13(32-22-21(30)20(29)19(28)16(7-23)33-22)6-15-17(18(8)27)12(26)5-14(31-15)9-2-3-10(24)11(25)4-9/h2-4,6,14,16,19-25,27-30H,5,7H2,1H3
InChIKeyFTKJSZFYBZXIDP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
5,7,3',4'-Tetrahydroxy-6-C-methylflavanone 7-O-glucoside (CHEBI:185476) is a flavonoids (CHEBI:72544)
5,7,3',4'-Tetrahydroxy-6-C-methylflavanone 7-O-glucoside (CHEBI:185476) is a glycoside (CHEBI:24400)
IUPAC Name 
2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methyl-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Manual XrefsDatabases
LMPK12140357LIPID MAPS
24846434ChemSpider