N-acetyl-L-aspartic acid (CHEBI:21547)

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ChEBI Name	N-acetyl-L-aspartic acid

ChEBI ID	CHEBI:21547

ChEBI ASCII Name	N-acetyl-L-aspartic acid

Definition	An N-acyl-L-aspartic acid in which the acyl group is specified as acetyl.

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

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Formula

C6H9NO5

Net Charge

Average Mass

175.13940

Monoisotopic Mass

175.04807

InChI

InChI=1S/C6H9NO5/c1-3(8)7-4(6(11)12)2-5(9)10/h4H,2H2,1H3,(H,7,8)(H,9,10)(H,11,12)/t4-/m0/s1

InChIKey

OTCCIMWXFLJLIA-BYPYZUCNSA-N

SMILES

CC(=O)N[C@@H](CC(O)=O)C(O)=O

Roles Classification
Chemical Role(s):	antioxidant A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides. Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). rat metabolite Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).

Application(s):	nutraceutical A product in capsule, tablet or liquid form that provide essential nutrients, such as a vitamin, an essential mineral, a protein, an herb, or similar nutritional substance.

ChEBI Ontology
Outgoing	N-acetyl-L-aspartic acid (CHEBI:21547) has role antioxidant (CHEBI:22586) N-acetyl-L-aspartic acid (CHEBI:21547) has role human metabolite (CHEBI:77746) N-acetyl-L-aspartic acid (CHEBI:21547) has role mouse metabolite (CHEBI:75771) N-acetyl-L-aspartic acid (CHEBI:21547) has role nutraceutical (CHEBI:50733) N-acetyl-L-aspartic acid (CHEBI:21547) has role rat metabolite (CHEBI:86264) N-acetyl-L-aspartic acid (CHEBI:21547) is a N-acetyl-L-amino acid (CHEBI:21545) N-acetyl-L-aspartic acid (CHEBI:21547) is a N-acyl-L-aspartic acid (CHEBI:21647) N-acetyl-L-aspartic acid (CHEBI:21547) is conjugate acid of N-acetyl-L-aspartate(2−) (CHEBI:16953)

Incoming	Ac-Asp-Glu (CHEBI:73688) has functional parent N-acetyl-L-aspartic acid (CHEBI:21547) N-acetyl-L-aspartic acid-1,2,3,4-¹³C₄ (CHEBI:176586) is a N-acetyl-L-aspartic acid (CHEBI:21547) N-acetyl-L-aspartate(2−) (CHEBI:16953) is conjugate base of N-acetyl-L-aspartic acid (CHEBI:21547)

IUPAC Name

(2S)-2-acetamidobutanedioic acid

Synonyms	Sources
(S)-2-(acetylamino)butanedioic acid	ChEBI
(S)-2-(acetylamino)succinic acid	HMDB
acetyl-L-aspartic acid	HMDB
acetylaspartic acid	ChemIDplus
L-N-acetylaspartic acid	HMDB
N-acetylaspartic acid	ChemIDplus
NAA	HMDB

Last Modified

24 June 2021