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CHEBI:77064 - Ac-Asp-Glu-Glu

ChEBI IDCHEBI:77064
ChEBI NameAc-Asp-Glu-Glu
Stars
DefinitionA dipeptide composed of one N-acetyl-L-aspartic acid and two L-glutamic acid units joined in sequence.
Last Modified2 August 2016
SubmitterSteve
DownloadsMolfile
FormulaC16H23N3O11
Net Charge0
Average Mass433.370
Monoisotopic Mass433.13326
SMILESCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIInChI=1S/C16H23N3O11/c1-7(20)17-10(6-13(25)26)15(28)18-8(2-4-11(21)22)14(27)19-9(16(29)30)3-5-12(23)24/h8-10H,2-6H2,1H3,(H,17,20)(H,18,28)(H,19,27)(H,21,22)(H,23,24)(H,25,26)(H,29,30)/t8-,9-,10-/m0/s1
InChIKeyXNHNFLZMOUNVIW-GUBZILKMSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Ac-Asp-Glu-Glu (CHEBI:77064) is a tripeptide (CHEBI:47923)
Ac-Asp-Glu-Glu (CHEBI:77064) is conjugate acid of Ac-Asp-Glu-Glu(4−) (CHEBI:76935)
Incoming Relation(s)
Ac-Asp-Glu-Glu(4−) (CHEBI:76935) is conjugate base of Ac-Asp-Glu-Glu (CHEBI:77064)
IUPAC Name 
N-acetyl-L-α-aspartyl-L-α-glutamyl-L-glutamic acid
Synonyms  Source
Ac-DEEChEBI
Ac-L-Asp-L-Glu-L-GluChEBI
N-acetylaspartylglutamylglutamic acidChEBI
N-acetyl-α-aspartyl-α-glutamylglutamic acidChEBI