EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:196621 - 5,7,8-Trihydroxyflavanone 7-glucoside

Default Structure
ChEBI IDCHEBI:196621
ChEBI Name5,7,8-Trihydroxyflavanone 7-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O10
Net Charge0
Average Mass434.397
Monoisotopic Mass434.12130
SMILESO=C1CC(c2ccccc2)Oc2c(O)c(OC3OC(CO)C(O)C(O)C3O)cc(O)c21
InChIInChI=1S/C21H22O10/c22-8-14-16(25)18(27)19(28)21(31-14)30-13-7-11(24)15-10(23)6-12(29-20(15)17(13)26)9-4-2-1-3-5-9/h1-5,7,12,14,16,18-19,21-22,24-28H,6,8H2
InChIKeyBDRAFLNAVDEXHK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5,7,8-Trihydroxyflavanone 7-glucoside (CHEBI:196621) is a flavonoids (CHEBI:72544)
5,7,8-Trihydroxyflavanone 7-glucoside (CHEBI:196621) is a glycoside (CHEBI:24400)
IUPAC Name 
5,8-dihydroxy-2-phenyl-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Manual XrefsDatabases
HMDB0038775HMDB