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ChEBI
> Main
CHEBI:86512 - calycosin-7-
O
-β-
D
-glucoside
Main
ChEBI Ontology
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ChEBI Name
calycosin-7-
O
-β-
D
-glucoside
ChEBI ID
CHEBI:86512
ChEBI ASCII Name
calycosin-7-O-beta-D-glucoside
Definition
A glycosyloxyisoflavone that is calycosin substituted by a β-
D
-glucopyranosyl residue at position at 7 via a glycosidic linkage.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C22H22O10
Net Charge
0
Average Mass
446.40410
Monoisotopic Mass
446.12130
InChI
InChI=1S/C22H22O10/c1-
29-
15-
5-
2-
10(6-
14(15)
24)
13-
9-
30-
16-
7-
11(3-
4-
12(16)
18(13)
25)
31-
22-
21(28)
20(27)
19(26)
17(8-
23)
32-
22/h2-
7,9,17,19-
24,26-
28H,8H2,1H3/t17-
,19-
,20+,21-
,22-
/m1/s1
InChIKey
WACBUPFEGWUGPB-MIUGBVLSSA-N
SMILES
COc1ccc(cc1O)-c1coc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2c1=O
Metabolite of Species
Details
Astragalus mongholicus
(NCBI:txid119829)
See:
PubMed
ChEBI Ontology
Outgoing
calycosin-7-
O
-β-
D
-glucoside (
CHEBI:86512
)
has functional parent
calycosin (
CHEBI:17793
)
calycosin-7-
O
-β-
D
-glucoside (
CHEBI:86512
)
is a
4'-methoxyisoflavones (
CHEBI:133959
)
calycosin-7-
O
-β-
D
-glucoside (
CHEBI:86512
)
is a
7-hydroxyisoflavones 7-
O
-β-
D
-glucoside (
CHEBI:140301
)
calycosin-7-
O
-β-
D
-glucoside (
CHEBI:86512
)
is a
hydroxyisoflavone (
CHEBI:38755
)
calycosin-7-
O
-β-
D
-glucoside (
CHEBI:86512
)
is a
monosaccharide derivative (
CHEBI:63367
)
IUPAC Name
3-
(3-
hydroxy-
4-
methoxyphenyl)-
4-
oxo-
4
H
-
1-
benzopyran-
7-
yl β-
D
-
glucopyranoside
Citations
Types
Sources
18346946
PubMed citation
Europe PMC
24417088
PubMed citation
Europe PMC
25844502
PubMed citation
Europe PMC
Last Modified
03 March 2018