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CHEBI:164441 - His-Glu-Glu

Default Structure
ChEBI IDCHEBI:164441
ChEBI NameHis-Glu-Glu
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H23N5O8
Net Charge0
Average Mass413.387
Monoisotopic Mass413.15466
SMILESN[C@@H](Cc1cncn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIInChI=1S/C16H23N5O8/c17-9(5-8-6-18-7-19-8)14(26)20-10(1-3-12(22)23)15(27)21-11(16(28)29)2-4-13(24)25/h6-7,9-11H,1-5,17H2,(H,18,19)(H,20,26)(H,21,27)(H,22,23)(H,24,25)(H,28,29)/t9-,10-,11-/m0/s1
InChIKeyTXLQHACKRLWYCM-DCAQKATOSA-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)
His-Glu-Glu (CHEBI:164441) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-4-carboxybutanoyl]amino]pentanedioic acid