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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:28529 - quercetin 7-
O
-β-
D
-glucoside
Main
ChEBI Ontology
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ChEBI Name
quercetin 7-
O
-β-
D
-glucoside
ChEBI ID
CHEBI:28529
ChEBI ASCII Name
quercetin 7-O-beta-D-glucoside
Definition
A quercetin
O
-glucoside in which a glucosyl residue is attached at position 7 of quercetin via a β-glycosidic linkage.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:26480, CHEBI:8704, CHEBI:32084
Supplier Information
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Formula
C21H22O12
Net Charge
0
Average Mass
464.37630
Monoisotopic Mass
464.09548
InChI
InChI=1S/C21H20O12/c22-
6-
13-
15(26)
17(28)
19(30)
21(33-
13)
31-
8-
4-
11(25)
14-
12(5-
8)
32-
20(18(29)
16(14)
27)
7-
1-
2-
9(23)
10(24)
3-
7/h1-
5,13,15,17,19,21-
26,28-
30H,6H2/t13-
,15-
,17+,19-
,21-
/m1/s1
InChIKey
BBFYUPYFXSSMNV-HMGRVEAOSA-N
SMILES
OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(-c2ccc(O)c(O)c2)c(O)c3=O)[C@H](O)[C@@H](O)[C@@H]1O
Roles Classification
Chemical Role
(s):
antioxidant
A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
quercetin 7-
O
-β-
D
-glucoside (
CHEBI:28529
)
has role
antioxidant (
CHEBI:22586
)
quercetin 7-
O
-β-
D
-glucoside (
CHEBI:28529
)
has role
metabolite (
CHEBI:25212
)
quercetin 7-
O
-β-
D
-glucoside (
CHEBI:28529
)
is a
β-
D
-glucoside (
CHEBI:22798
)
quercetin 7-
O
-β-
D
-glucoside (
CHEBI:28529
)
is a
flavonols (
CHEBI:28802
)
quercetin 7-
O
-β-
D
-glucoside (
CHEBI:28529
)
is a
monosaccharide derivative (
CHEBI:63367
)
quercetin 7-
O
-β-
D
-glucoside (
CHEBI:28529
)
is a
quercetin
O
-glucoside (
CHEBI:64621
)
quercetin 7-
O
-β-
D
-glucoside (
CHEBI:28529
)
is a
tetrahydroxyflavone (
CHEBI:38684
)
IUPAC Name
2-
(3,4-
dihydroxyphenyl)-
3,5-
dihydroxy-
4-
oxo-
4
H
-
chromen-
7-
yl β-
D
-
glucopyranoside
Synonyms
Sources
2-(3,4-Dihydroxyphenyl)-7-(beta-D-glucopyranosyloxy)-3,5-dihydroxy-4H-1-benzopyran-4-one
ChemIDplus
3,5-Dihydroxy-2-(3,4-dihydroxyphenyl)-7-(beta-D-glucopyranosyloxy)-4H-1-benzopyran-4-one
ChemIDplus
Quercetin 7-O-beta-D-glucoside
KEGG COMPOUND
Quercetin 7-O-glucoside
KEGG COMPOUND
quercimeritrin
MetaCyc
Quercimeritroside
ChemIDplus
Manual Xrefs
Databases
C00005382
KNApSAcK
C12639
KEGG COMPOUND
CN101375937
Patent
CPD-8006
MetaCyc
LMPK12112179
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
491-50-9
CAS Registry Number
KEGG COMPOUND
491-50-9
CAS Registry Number
ChemIDplus
70125
Reaxys Registry Number
Reaxys
Citations
Types
Sources
10418337
PubMed citation
Europe PMC
22085305
PubMed citation
Europe PMC
22741463
PubMed citation
Europe PMC
7942041
PubMed citation
Europe PMC
Last Modified
04 August 2014