2-imino-3-methylene-5-L-(carboxy-L-threoninyl)pyrrolidine (CHEBI:200928)

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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-imino-3-methylene-5-L-(carboxy-L-threoninyl)pyrrolidine

ChEBI ID	CHEBI:200928

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C10H15N3O4

Net Charge

Average Mass

241.247

Monoisotopic Mass

241.10626

InChI

InChI=1S/C10H15N3O4/c1-4-3-6(12-8(4)11)9(15)13-7(5(2)14)10(16)17/h5-7,14H,1,3H2,2H3,(H2,11,12)(H,13,15)(H,16,17)/t5-,6+,7+/m1/s1

InChIKey

BQWZMMMOWXGNRM-VQVTYTSYSA-N

SMILES

O=C(N[C@H](C(=O)O)[C@H](O)C)[C@H]1N=C(N)C(C1)=C

Metabolite of Species	Details
Burkholderia plantarii (NCBI:txid41899)	See: PubMed

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-imino-3-methylene-5-L-(carboxy-L-threoninyl)pyrrolidine (CHEBI:200928) is a N-acyl-L-amino acid (CHEBI:21644)

IUPAC Name

(2S,3R)-2-[[(2S)-5-amino-4-methylidene-2,3-dihydropyrrole-2-carbonyl]amino]-3-hydroxybutanoic acid