CHEBI:76931 - Ac-Asp-Glu(3−)

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ChEBI Name Ac-Asp-Glu(3−) ChEBI ID CHEBI:76931 ChEBI ASCII Name Ac-Asp-Glu(3-) Definition A peptide anion obtained by deprotonation of the three carboxy groups of N-acetyl-Asp-Glu; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter KAX Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C11H13N2O8 Net Charge -3 Average Mass 301.23120 Monoisotopic Mass 301.06884 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 SMILES CC(=O)N[C@@H](CC([O-])=O)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O ChEBI Ontology Outgoing Ac-Asp-Glu(3−) (CHEBI:76931) is a peptide anion (CHEBI:60334) Ac-Asp-Glu(3−) (CHEBI:76931) is conjugate base of Ac-Asp-Glu (CHEBI:73688) Incoming Ac-Asp-Glu (CHEBI:73688) is conjugate acid of Ac-Asp-Glu(3−) (CHEBI:76931) IUPAC Name (2S)-2-{[(2S)-2-acetamido-3-carboxylatopropanoyl]amino}pentanedioate Synonyms Sources N-acetyl-L-aspartyl-L-glutamate UniProt N-acetylaspartylglutamate SUBMITTER Citation Type Source 20643647 PubMed citation SUBMITTER Last Modified 21 January 2014