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> Main
CHEBI:80373 - glycitin
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ChEBI Ontology
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ChEBI Name
glycitin
ChEBI ID
CHEBI:80373
Definition
A glycosyloxyisoflavone that is isoflavone substituted by a methoxy group at position 6, a hydroxy group at position 4' and a β-
D
-glucopyranosyloxy group at position 7.
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-
6-
12-
14(30-
9-
13(18(12)
25)
10-
2-
4-
11(24)
5-
3-
10)
7-
16(15)
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
OZBAVEKZGSOMOJ-MIUGBVLSSA-N
SMILES
COc1cc2c(cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)occ(-c1ccc(O)cc1)c2=O
Metabolite of Species
Details
Centella asiatica
(NCBI:txid48106)
See:
MetaboLights Study
Roles Classification
Biological Role
(s):
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
glycitin (
CHEBI:80373
)
has role
plant metabolite (
CHEBI:76924
)
glycitin (
CHEBI:80373
)
is a
7-hydroxyisoflavones 7-
O
-β-
D
-glucoside (
CHEBI:140301
)
glycitin (
CHEBI:80373
)
is a
hydroxyisoflavone (
CHEBI:38755
)
glycitin (
CHEBI:80373
)
is a
methoxyisoflavone (
CHEBI:38756
)
glycitin (
CHEBI:80373
)
is a
monosaccharide derivative (
CHEBI:63367
)
Incoming
glycitein 7-(6-
O
-acetyl-β-
D
-glucoside) (
CHEBI:133348
)
has functional parent
glycitin (
CHEBI:80373
)
glycitein 7-
O
-β-
D
-(2'',4'',6''-
O
-triacetyl)glucopyranoside (
CHEBI:85132
)
has functional parent
glycitin (
CHEBI:80373
)
malonylglycitin (
CHEBI:80374
)
has functional parent
glycitin (
CHEBI:80373
)
IUPAC Name
3-(4-hydroxyphenyl)-6-methoxy-4-oxo-4
H
-chromen-7-yl β-
D
-glucopyranoside
Synonym
Source
Glycitein 7-O-glucoside
KEGG COMPOUND
Manual Xrefs
Databases
C00010089
KNApSAcK
C16195
KEGG COMPOUND
HMDB0002219
HMDB
View more database links
Registry Numbers
Types
Sources
40246-10-4
CAS Registry Number
ChemIDplus
4339336
Reaxys Registry Number
Reaxys
Citations
Types
Sources
24872524
PubMed citation
Europe PMC
25209298
PubMed citation
Europe PMC
Last Modified
03 March 2018