2-{[(3,5-dimethoxyphenyl)(hydroxy)methylidene]amino}acetic acid (CHEBI:168859)

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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-{[(3,5-dimethoxyphenyl)(hydroxy)methylidene]amino}acetic acid

ChEBI ID	CHEBI:168859

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C11H13NO5

Net Charge

Average Mass

239.227

Monoisotopic Mass

239.07937

InChI

InChI=1S/C11H13NO5/c1-16-8-3-7(4-9(5-8)17-2)11(15)12-6-10(13)14/h3-5H,6H2,1-2H3,(H,12,15)(H,13,14)

InChIKey

UFBSPOIKQBQXCT-UHFFFAOYSA-N

SMILES

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

Metabolite of Species	Details
Malus domestica (NCBI:txid3750)	Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue 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-{[(3,5-dimethoxyphenyl)(hydroxy)methylidene]amino}acetic acid (CHEBI:168859) has functional parent N-benzoylglycine (CHEBI:18089) 2-{[(3,5-dimethoxyphenyl)(hydroxy)methylidene]amino}acetic acid (CHEBI:168859) is a N-acylglycine (CHEBI:16180)

IUPAC Name

2-[(3,5-dimethoxybenzoyl)amino]acetic acid