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CHEBI:75821 - myricetin 3-O-α-L-glucopyranoside

ChEBI IDCHEBI:75821
ChEBI Namemyricetin 3-O-α-L-glucopyranoside
Stars
ASCII Namemyricetin 3-O-alpha-L-glucopyranoside
DefinitionA myricetin O-glucoside that is myricetin with a α-L-glucosyl residue attached at position 3.
Last Modified28 November 2013
Submittermwilliams
DownloadsMolfile
FormulaC21H20O13
Net Charge0
Average Mass480.378
Monoisotopic Mass480.09039
SMILESO=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12
InChIInChI=1S/C21H20O13/c22-5-12-15(28)17(30)18(31)21(33-12)34-20-16(29)13-8(24)3-7(23)4-11(13)32-19(20)6-1-9(25)14(27)10(26)2-6/h1-4,12,15,17-18,21-28,30-31H,5H2/t12-,15-,17+,18-,21-/m0/s1
InChIKeyFOHXFLPXBUAOJM-UPPCLWNPSA-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)
myricetin 3-O-α-L-glucopyranoside (CHEBI:75821) has functional parent α-L-glucose (CHEBI:37630)
myricetin 3-O-α-L-glucopyranoside (CHEBI:75821) has role metabolite (CHEBI:25212)
myricetin 3-O-α-L-glucopyranoside (CHEBI:75821) is a monosaccharide derivative (CHEBI:63367)
myricetin 3-O-α-L-glucopyranoside (CHEBI:75821) is a myricetin O-glucoside (CHEBI:75812)
myricetin 3-O-α-L-glucopyranoside (CHEBI:75821) is a pentahydroxyflavone (CHEBI:25883)
myricetin 3-O-α-L-glucopyranoside (CHEBI:75821) is a α-L-glucoside (CHEBI:71351)
IUPAC Name 
5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)-4H-chromen-3-yl α-L-glucopyranoside
Registry NumbersSources
Reaxys:1445032Reaxys