2-[3-(Formylamino)-2-hydroxybenzoylamino]-3-hydroxybutanoic acid methyl ester (CHEBI:182222)

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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-(Formylamino)-2-hydroxybenzoylamino]-3-hydroxybutanoic acid methyl ester

ChEBI ID	CHEBI:182222

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

Submitter	MetaboLights

Supplier Information

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Formula

C13H16N2O6

Net Charge

Average Mass

296.279

Monoisotopic Mass

296.10084

InChI

InChI=1S/C13H16N2O6/c1-7(17)10(13(20)21-2)15-12(19)8-4-3-5-9(11(8)18)14-6-16/h3-7,10,17-18H,1-2H3,(H,14,16)(H,15,19)

InChIKey

FKDSAXOHMLWBNA-UHFFFAOYSA-N

SMILES

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

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-(Formylamino)-2-hydroxybenzoylamino]-3-hydroxybutanoic acid methyl ester (CHEBI:182222) is a amidobenzoic acid (CHEBI:48470)

IUPAC Name

methyl 2-[(3-ormamido-2-hydroxybenzoyl)amino]-3-hydroxybutanoate