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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:59128 -
O
-methylsalicylate
Main
ChEBI Ontology
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ChEBI Name
O
-methylsalicylate
ChEBI ID
CHEBI:59128
ChEBI ASCII Name
O-methylsalicylate
Definition
Conjugate base of
O
-methylsalicylic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C8H7O3
Net Charge
-1
Average Mass
151.13940
Monoisotopic Mass
151.04007
InChI
InChI=1S/C8H8O3/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5H,1H3,(H,9,10)/p-1
InChIKey
ILUJQPXNXACGAN-UHFFFAOYSA-M
SMILES
COc1ccccc1C([O-])=O
ChEBI Ontology
Outgoing
O
-methylsalicylate (
CHEBI:59128
)
is a
methoxybenzoate (
CHEBI:25236
)
O
-methylsalicylate (
CHEBI:59128
)
is conjugate base of
O
-methylsalicylic acid (
CHEBI:421840
)
Incoming
2-methoxybenzoyl-AMP(1−) (
CHEBI:188493
)
has functional parent
O
-methylsalicylate (
CHEBI:59128
)
2-methoxybenzoyl-CoA(1−) (
CHEBI:188490
)
has functional parent
O
-methylsalicylate (
CHEBI:59128
)
3,6-dichloro-2-methoxybenzoate (
CHEBI:141349
)
has functional parent
O
-methylsalicylate (
CHEBI:59128
)
O
-methylsalicylic acid (
CHEBI:421840
)
is conjugate acid of
O
-methylsalicylate (
CHEBI:59128
)
Synonyms
Sources
2-methoxybenzoate
UniProt
o
-methoxybenzoic acid anion
ChEBI
Registry Numbers
Types
Sources
329974
Gmelin Registry Number
Gmelin
3905613
Beilstein Registry Number
Beilstein
3905613
Reaxys Registry Number
Reaxys
Last Modified
24 September 2021