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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.
Supplier Information
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Formula Source
C6H9NO5 ChEBI
Net Charge 0
Average Mass 175.13940
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): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): secondary metabolite
A metabolite that is not directly involved in the normal growth, development or reproduction of an organism.
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.
View more on the ChEBI Ontology
ChEBI Ontology
Outgoing N-acetyl-L-aspartic acid (CHEBI:21547) has functional parent L-aspartic acid (CHEBI:17053)
N-acetyl-L-aspartic acid (CHEBI:21547) has role nutraceutical (CHEBI:50733)
N-acetyl-L-aspartic acid (CHEBI:21547) has role secondary metabolite (CHEBI:26619)
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-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
Database Links Databases
C01042 KEGG COMPOUND
CPD-420 MetaCyc
HMDB00812 HMDB
N-acetylaspartic_acid Wikipedia
View more database links
Registry Numbers Types Sources
1726198 Reaxys Registry Number Reaxys
1726198 Beilstein Registry Number ChemIDplus
997-55-7 CAS Registry Number ChemIDplus
997-55-7 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
1400776 PubMed citation CiteXplore
1583881 PubMed citation CiteXplore
17190852 PubMed citation CiteXplore
17703473 PubMed citation CiteXplore
19445994 PubMed citation CiteXplore
19816853 PubMed citation CiteXplore
20362635 PubMed citation CiteXplore
20946933 PubMed citation CiteXplore
21547934 PubMed citation CiteXplore
21608034 PubMed citation CiteXplore
21920405 PubMed citation CiteXplore
22284151 PubMed citation CiteXplore
2272391 PubMed citation CiteXplore
22770225 PubMed citation CiteXplore
2324740 PubMed citation CiteXplore
6131106 PubMed citation CiteXplore
Last Modified
17 May 2013

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