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CHEBI:77992 - calycosin(1−)
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ChEBI Name
calycosin(1−)
ChEBI ID
CHEBI:77992
ChEBI ASCII Name
calycosin(1-)
Definition
A flavonoid oxoanion obtained by deprotonation of the hydroxy group at position 7 of calycosin. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Anne Morgat
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Formula
C16H11O5
Net Charge
-1
Average Mass
283.25610
Monoisotopic Mass
283.06120
InChI
InChI=1S/C16H12O5/c1-
20-
14-
5-
2-
9(6-
13(14)
18)
12-
8-
21-
15-
7-
10(17)
3-
4-
11(15)
16(12)
19/h2-
8,17-
18H,1H3/p-
1
InChIKey
ZZAJQOPSWWVMBI-UHFFFAOYSA-M
SMILES
COc1ccc(cc1O)-c1coc2cc([O-])ccc2c1=O
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
calycosin(1−) (
CHEBI:77992
)
has role
antioxidant (
CHEBI:22586
)
calycosin(1−) (
CHEBI:77992
)
has role
metabolite (
CHEBI:25212
)
calycosin(1−) (
CHEBI:77992
)
is a
flavonoid oxoanion (
CHEBI:60038
)
calycosin(1−) (
CHEBI:77992
)
is conjugate base of
calycosin (
CHEBI:17793
)
Incoming
calycosin (
CHEBI:17793
)
is conjugate acid of
calycosin(1−) (
CHEBI:77992
)
IUPAC Name
3-(3-hydroxy-4-methoxyphenyl)-4-oxo-4
H
-chromen-7-olate
Synonym
Source
calycosin
UniProt
Last Modified
23 June 2014