(2S)-3-(3-Carbamoyloxiranylcarbonylamino)-2-aminopropanoic acid (CHEBI:181411)

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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	(2S)-3-(3-Carbamoyloxiranylcarbonylamino)-2-aminopropanoic acid

ChEBI ID	CHEBI:181411

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C7H11N3O5

Net Charge

Average Mass

217.181

Monoisotopic Mass

217.06987

InChI

InChI=1S/C7H11N3O5/c8-2(7(13)14)1-10-6(12)4-3(15-4)5(9)11/h2-4H,1,8H2,(H2,9,11)(H,10,12)(H,13,14)/t2-,3?,4?/m0/s1

InChIKey

LQRXQGMIBGPNBY-WXJVFSNFSA-N

SMILES

O1C(C1C(=O)N)C(=O)NC[C@H](N)C(O)=O

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

ChEBI Ontology
Outgoing	(2S)-3-(3-Carbamoyloxiranylcarbonylamino)-2-aminopropanoic acid (CHEBI:181411) is a L-α-amino acid (CHEBI:15705)

IUPAC Name

(2S)-2-amino-3-[(3-carbamoyloxirane-2-carbonyl)amino]propanoic acid