N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine (CHEBI:145231)

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ChEBI Name	N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine

ChEBI ID	CHEBI:145231

ChEBI ASCII Name	N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine

Definition	A dipeptide that is N-[(2S)-2-aminobutanoyl]glycine in which the terminal amino group has been acylated by formal condensation of the 5-carboxy group of 2-oxopentanedioic acid.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C11H16N2O7

Net Charge

Average Mass

288.256

Monoisotopic Mass

288.09575

InChI

InChI=1S/C11H16N2O7/c1-2-6(10(18)12-5-9(16)17)13-8(15)4-3-7(14)11(19)20/h6H,2-5H2,1H3,(H,12,18)(H,13,15)(H,16,17)(H,19,20)/t6-/m0/s1

InChIKey

RRBLCHIJUKCUNR-LURJTMIESA-N

SMILES

O=C(N[C@H](C(=O)NCC(O)=O)CC)CCC(=O)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	N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine (CHEBI:145231) is a dipeptide (CHEBI:46761) N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine (CHEBI:145231) is a oxo dicarboxylic acid (CHEBI:36145) N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine (CHEBI:145231) is a secondary carboxamide (CHEBI:140325) N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine (CHEBI:145231) is conjugate acid of N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine(2−) (CHEBI:144697)

Incoming	N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine(2−) (CHEBI:144697) is conjugate base of N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine (CHEBI:145231)

IUPAC Name

5-({(2S)-1-[(carboxymethyl)amino]-1-oxobutan-2-yl}amino)-2,5-dioxopentanoic acid

Synonyms	Sources
CLONE_N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine	ChEBI
N-[(2S)-2-(4-carboxy-4-oxobutanoylamino)butanoyl]glycine	ChEBI

Last Modified

29 October 2019