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CHEBI:76942 - β-citrylglutamate(4−)

ChEBI IDCHEBI:76942
ChEBI Nameβ-citrylglutamate(4−)
Stars
ASCII Namebeta-citrylglutamate(4-)
DefinitionA tetracarboxylic acid anion obtained by deprotonation of the four carboxy groups of β-citrylglutamic acid; major species at pH 7.3.
Last Modified10 August 2016
SubmitterKAX
DownloadsMolfile
FormulaC11H11NO10
Net Charge-4
Average Mass317.206
Monoisotopic Mass317.04049
SMILESO=C([O-])CC[C@H](NC(=O)C(O)(CC(=O)[O-])CC(=O)[O-])C(=O)[O-]
InChIInChI=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
InChIKeyGAQNUGISBQJMKO-YFKPBYRVSA-J
ChEBI Ontology
Outgoing Relation(s)
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
UniProt Name  Source
β-citrylglutamateUniProt
Citations