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CHEBI:59015 - hesperetin 7-O-β-D-glucoside

Default Structure
ChEBI IDCHEBI:59015
ChEBI Namehesperetin 7-O-β-D-glucoside
Stars
ASCII Namehesperetin 7-O-beta-D-glucoside
DefinitionA flavanone 7-O-β-D-glucoside having hesperetin as the flavanone component.
Last Modified19 August 2020
SubmitterSteve
DownloadsMolfile
FormulaC22H24O11
Net Charge0
Average Mass464.423
Monoisotopic Mass464.13186
SMILESCOc1ccc([C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1O
InChIInChI=1S/C22H24O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-6,15,17,19-25,27-29H,7-8H2,1H3/t15-,17+,19+,20-,21+,22+/m0/s1
InChIKeyADSYMQORONDIDD-ZJHVPRRPSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
hesperetin 7-O-β-D-glucoside (CHEBI:59015) has functional parent hesperetin (CHEBI:28230)
hesperetin 7-O-β-D-glucoside (CHEBI:59015) has role metabolite (CHEBI:25212)
hesperetin 7-O-β-D-glucoside (CHEBI:59015) is a 3'-hydroxyflavanones (CHEBI:48024)
hesperetin 7-O-β-D-glucoside (CHEBI:59015) is a 4'-methoxyflavanones (CHEBI:140332)
hesperetin 7-O-β-D-glucoside (CHEBI:59015) is a dihydroxyflavanone (CHEBI:38749)
hesperetin 7-O-β-D-glucoside (CHEBI:59015) is a flavanone 7-O-β-D-glucoside (CHEBI:13637)
hesperetin 7-O-β-D-glucoside (CHEBI:59015) is a monomethoxyflavanone (CHEBI:38738)
hesperetin 7-O-β-D-glucoside (CHEBI:59015) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name 
(2S)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-7-yl β-D-glucopyranoside
Synonyms  Source
Eriodictiol-7-glucosideChemIDplus
Hesperetin 7-O-glucosideKEGG COMPOUND
UniProt Name  Source
(2S)-hesperetin 7-O-β-D-glucosideUniProt
Manual XrefsDatabases
C00008297KNApSAcK
C16422KEGG COMPOUND
HMDB0030747HMDB
Registry NumbersSources
Reaxys:8661664Reaxys
CAS:31712-49-9KEGG COMPOUND
CAS:31712-49-9ChemIDplus
Citations