5-methoxysalicylic acid (CHEBI:89830)

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ChEBI Name	5-methoxysalicylic acid

ChEBI ID	CHEBI:89830

Definition	A methoxysalicylic acid that is salicylic acid which is carrying a methoxy group at position 5.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information	ChemicalBook:CB1466366, eMolecules:482159, ZINC000000157039

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Formula

C8H8O4

Net Charge

Average Mass

168.148

Monoisotopic Mass

168.04226

InChI

InChI=1S/C8H8O4/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,9H,1H3,(H,10,11)

InChIKey

IZZIWIAOVZOBLF-UHFFFAOYSA-N

SMILES

O(C)C1=CC(C(=O)O)=C(O)C=C1

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples.

ChEBI Ontology
Outgoing	5-methoxysalicylic acid (CHEBI:89830) has role bacterial metabolite (CHEBI:76969) 5-methoxysalicylic acid (CHEBI:89830) has role human urinary metabolite (CHEBI:84087) 5-methoxysalicylic acid (CHEBI:89830) is a methoxysalicylic acid (CHEBI:149777)

IUPAC Name

2-hydroxy-5-methoxybenzoic acid

Synonyms	Sources
5-MeOSA	ChEBI
5-methoxy-2-hydroxybenzoic acid	ChemIDplus
5-O-methyl gentisic acid	ChEBI
6-hydroxy-m-anisic acid	ChemIDplus
acid5-methoxysalicylic	ChemIDplus

Last Modified

26 May 2020