2-HYDROXY-3,4-DIMETHOXYBENZOIC ACID (CHEBI:184501)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	2-HYDROXY-3,4-DIMETHOXYBENZOIC ACID

ChEBI ID	CHEBI:184501

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C9H10O5

Net Charge

Average Mass

198.174

Monoisotopic Mass

198.05282

InChI

InChI=1S/C9H10O5/c1-13-6-4-3-5(9(11)12)7(10)8(6)14-2/h3-4,10H,1-2H3,(H,11,12)

InChIKey

CJFQIVAOBBTJCI-UHFFFAOYSA-N

SMILES

O(C1=C(OC)C=CC(=C1O)C(O)=O)C

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

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

ChEBI Ontology
Outgoing	2-HYDROXY-3,4-DIMETHOXYBENZOIC ACID (CHEBI:184501) is a methoxybenzoic acid (CHEBI:25238)

IUPAC Name

2-hydroxy-3,4-dimethoxybenzoic acid

Registry Number	Type	Source
5653-46-3	CAS Registry Number	ChemIDplus