Madurastatin B2 (CHEBI:182135)

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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	Madurastatin B2

ChEBI ID	CHEBI:182135

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C10H11NO5

Net Charge

Average Mass

225.200

Monoisotopic Mass

225.06372

InChI

InChI=1S/C10H11NO5/c12-5-7(10(15)16)11-9(14)6-3-1-2-4-8(6)13/h1-4,7,12-13H,5H2,(H,11,14)(H,15,16)/t7-/m1/s1

InChIKey

SAEFXOJAEDXDBM-SSDOTTSWSA-N

SMILES

OC[C@@H](NC(=O)C=1C(O)=CC=CC1)C(O)=O

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	Madurastatin B2 (CHEBI:182135) has functional parent N-benzoylglycine (CHEBI:18089) Madurastatin B2 (CHEBI:182135) is a N-acylglycine (CHEBI:16180)

IUPAC Name

(2R)-3-hydroxy-2-[(2-hydroxybenzoyl)amino]propanoic acid