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CHEBI:28183 - fustin 3-O-β-D-galactoside

ChEBI IDCHEBI:28183
ChEBI Namefustin 3-O-β-D-galactoside
Stars
ASCII Namefustin 3-O-beta-D-galactoside
DefinitionA flavanone glycoside that consists of fustin attached to a β-D-galactosyl moiety at position 3 via a glycosidic linkage.
Secondary ChEBI IDsCHEBI:5079, CHEBI:24045
Last Modified5 April 2018
DownloadsMolfile
FormulaC21H22O11
Net Charge0
Average Mass450.396
Monoisotopic Mass450.11621
SMILES[H][C@@]1(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(=O)c2ccc(O)cc2O[C@]1([H])c1ccc(O)c(O)c1
InChIInChI=1S/C21H22O11/c22-7-14-16(27)17(28)18(29)21(31-14)32-20-15(26)10-3-2-9(23)6-13(10)30-19(20)8-1-4-11(24)12(25)5-8/h1-6,14,16-25,27-29H,7H2/t14-,16+,17+,18-,19-,20-,21+/m1/s1
InChIKeyQSWUCBJNTODEKO-PKOGLCCJSA-N
ChEBI Ontology
Outgoing Relation(s)
fustin 3-O-β-D-galactoside (CHEBI:28183) has functional parent fustin (CHEBI:5202)
fustin 3-O-β-D-galactoside (CHEBI:28183) is a 3'-hydroxyflavanones (CHEBI:48024)
fustin 3-O-β-D-galactoside (CHEBI:28183) is a 4'-hydroxyflavanones (CHEBI:140331)
fustin 3-O-β-D-galactoside (CHEBI:28183) is a flavanone glycoside (CHEBI:72730)
fustin 3-O-β-D-galactoside (CHEBI:28183) is a monosaccharide derivative (CHEBI:63367)
fustin 3-O-β-D-galactoside (CHEBI:28183) is a trihydroxyflavanone (CHEBI:38739)
fustin 3-O-β-D-galactoside (CHEBI:28183) is a β-D-galactoside (CHEBI:28034)
IUPAC Name 
(2R,3S)-2-(3,4-dihydroxyphenyl)-7-hydroxy-4-oxo-3,4-dihydro-2H-chromen-3-yl β-D-galactopyranoside
Manual XrefsDatabases
C03502KEGG COMPOUND