Terminology Service for NFDI4Health
Ac-Asp-Glu(3-)
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http://purl.obolibrary.org/obo/CHEBI_76931
A peptide anion obtained by deprotonation of the three carboxy groups of N-acetyl-Asp-Glu; major species at pH 7.3.
Term info
Label
Ac-Asp-Glu(3-)
Synonyms
- (2S)-2-{[(2S)-2-acetamido-3-carboxylatopropanoyl]amino}pentanedioate
Subsets
3_STAR
charge
-3
formula
C11H13N2O8
has obo namespace
chebi_ontology
has related synonym
N-acetylaspartylglutamate, N-acetyl-L-aspartyl-L-glutamate
id
CHEBI:76931
inchi
InChI=1S/C11H16N2O8/c1-5(14)12-7(4-9(17)18)10(19)13-6(11(20)21)2-3-8(15)16/h6-7H,2-4H2,1H3,(H,12,14)(H,13,19)(H,15,16)(H,17,18)(H,20,21)/p-3/t6-,7-/m0/s1
inchikey
OPVPGKGADVGKTG-BQBZGAKWSA-K
mass
301.23120
monoisotopicmass
301.06884
smiles
CC(=O)N[C@@H](CC([O-])=O)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O
Term relations
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