CHEBI:76942 - β-citrylglutamate(4−)

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ChEBI Name β-citrylglutamate(4−)
ChEBI ID CHEBI:76942
ChEBI ASCII Name beta-citrylglutamate(4-)
Definition A tetracarboxylic acid anion obtained by deprotonation of the four carboxy groups of β-citrylglutamic acid; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter KAX
Supplier Information ChemicalBook:CB3169304, eMolecules:530368, ZINC000001530303
Download Molfile XML SDF
Formula C11H11NO10
Net Charge -4
Average Mass 317.20790
Monoisotopic Mass 317.04049
InChI InChI=1S/C11H15NO10/c13-6(14)2-1-5(9(19)20)12-10(21)11(22,3-7(15)16)4-8(17)18/h5,22H,1-4H2,(H,12,21)(H,13,14)(H,15,16)(H,17,18)(H,19,20)/p-4/t5-/m0/s1
InChIKey GAQNUGISBQJMKO-YFKPBYRVSA-J
SMILES OC(CC([O-])=O)(CC([O-])=O)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O
ChEBI Ontology
Outgoing β-citrylglutamate(4−) (CHEBI:76942) is a N-acyl-L-α-amino acid anion (CHEBI:59874)
β-citrylglutamate(4−) (CHEBI:76942) is a tetracarboxylic acid anion (CHEBI:35754)
IUPAC Name
3-{[(1S)-1,3-dicarboxylatopropyl]carbamoyl}-3-hydroxypentanedioate
Synonym Source
β-citrylglutamate UniProt
Citation Type Source
20657015 PubMed citation SUBMITTER
Last Modified
10 August 2016