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ChEBI
> Main
CHEBI:28299 - quercetin 3-
O
-β-
D
-glucofuranoside
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ChEBI Name
quercetin 3-
O
-β-
D
-glucofuranoside
ChEBI ID
CHEBI:28299
ChEBI ASCII Name
quercetin 3-O-beta-D-glucofuranoside
Definition
A quercetin
O
-glucoside in which a glucofuranosyl residue is attached at position 3 of quercetin via a β-glycosidic linkage.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:8702, CHEBI:26478
Supplier Information
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Formula
C21H20O12
Net Charge
0
Average Mass
464.37630
Monoisotopic Mass
464.09548
InChI
InChI=1S/C21H20O12/c22-
6-
12(27)
19-
16(29)
17(30)
21(32-
19)
33-
20-
15(28)
14-
11(26)
4-
8(23)
5-
13(14)
31-
18(20)
7-
1-
2-
9(24)
10(25)
3-
7/h1-
5,12,16-
17,19,21-
27,29-
30H,6H2/t12-
,16-
,17-
,19-
,21+/m1/s1
InChIKey
OPJZLUXFQFQYAI-GNPVFZCLSA-N
SMILES
[H][C@@]1(O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](O)[C@H]1O)[C@H](O)CO
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
quercetin 3-
O
-β-
D
-glucofuranoside (
CHEBI:28299
)
has role
metabolite (
CHEBI:25212
)
quercetin 3-
O
-β-
D
-glucofuranoside (
CHEBI:28299
)
is a
β-
D
-glucoside (
CHEBI:22798
)
quercetin 3-
O
-β-
D
-glucofuranoside (
CHEBI:28299
)
is a
monosaccharide derivative (
CHEBI:63367
)
quercetin 3-
O
-β-
D
-glucofuranoside (
CHEBI:28299
)
is a
quercetin
O
-glucoside (
CHEBI:64621
)
quercetin 3-
O
-β-
D
-glucofuranoside (
CHEBI:28299
)
is a
tetrahydroxyflavone (
CHEBI:38684
)
IUPAC Name
2-
(3,4-
dihydroxyphenyl)-
5,7-
dihydroxy-
4-
oxo-
4
H
-
chromen-
3-
yl β-
D
-
glucofuranoside
Synonyms
Sources
2-(3,4-Dihidroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one
KEGG COMPOUND
3,3',4',5,7-Pentahydroxyflavone 3-beta-D-glucofuranoside
ChemIDplus
Isoquercitrin
KEGG COMPOUND
Isoquercitroside
ChemIDplus
Isotrifoliin
KEGG COMPOUND
Quercetin 3-O-glucoside
KEGG COMPOUND
Manual Xref
Database
C05623
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
1444784
Reaxys Registry Number
Reaxys
21637-25-2
CAS Registry Number
KEGG COMPOUND
21637-25-2
CAS Registry Number
ChemIDplus
Last Modified
29 July 2020
General Comment
2020-07-29
The glucose moiety in this structure is in the furanose (5-membered ring) form. There is a separate entry where the glucose moiety is in the pyranose (6-membered ring) form, CHEBI:68352.