CHEBI:67937 - 3-O-methylquercetin-7-O-β-D-glucopyranoside

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ChEBI Name 3-O-methylquercetin-7-O-β-D-glucopyranoside
ChEBI ID CHEBI:67937
ChEBI ASCII Name 3-O-methylquercetin-7-O-beta-D-glucopyranoside
Definition A quercetin O-glucoside that is 3-O-methylquercetin attached to a β-D-glucopyranosyl residue at position 7 via a glycosidic linkage. It has been isolated from Ophioglossum pedunculosum and Lepisorus contortus.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C22H22O12
Net Charge 0
Average Mass 478.40290
Monoisotopic Mass 478.11113
InChI InChI=1S/C22H22O12/c1-31-21-17(28)15-12(26)5-9(32-22-19(30)18(29)16(27)14(7-23)34-22)6-13(15)33-20(21)8-2-3-10(24)11(25)4-8/h2-6,14,16,18-19,22-27,29-30H,7H2,1H3/t14-,16-,18+,19-,22-/m1/s1
InChIKey LKXBGSZMRNJAST-UKWZQOBBSA-N
SMILES COc1c(oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c2c1=O)-c1ccc(O)c(O)c1
Metabolite of Species Details
Ophioglossum pedunculosum (NCBI:txid60874) Found in whole plant (BTO:0001461). 75% EtOH extract of dried whole plant See: PubMed
Lepisorus contortus (NCBI:txid699669) Found in whole plant (BTO:0001461). 95% EtOH extract of air-dried, powdered whole plant See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3-O-methylquercetin-7-O-β-D-glucopyranoside (CHEBI:67937) has role metabolite (CHEBI:25212)
3-O-methylquercetin-7-O-β-D-glucopyranoside (CHEBI:67937) has role plant metabolite (CHEBI:76924)
3-O-methylquercetin-7-O-β-D-glucopyranoside (CHEBI:67937) is a β-D-glucoside (CHEBI:22798)
3-O-methylquercetin-7-O-β-D-glucopyranoside (CHEBI:67937) is a monosaccharide derivative (CHEBI:63367)
3-O-methylquercetin-7-O-β-D-glucopyranoside (CHEBI:67937) is a quercetin O-glucoside (CHEBI:64621)
IUPAC Name
2-(3,4-dihydroxyphenyl)-5-hydroxy-3-methoxy-4-oxo-4H-chromen-7-yl β-D-glucopyranoside
Synonym Source
transilin ChEBI
Registry Number Type Source
1277270 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
21261296 PubMed citation Europe PMC
21401115 PubMed citation Europe PMC
Last Modified
26 November 2013