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CHEBI:162855 - Glu-Gln-His

ChEBI IDCHEBI:162855
ChEBI NameGlu-Gln-His
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H24N6O7
Net Charge0
Average Mass412.403
Monoisotopic Mass412.17065
SMILESNC(=O)CC[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](Cc1cncn1)C(=O)O
InChIInChI=1S/C16H24N6O7/c17-9(1-4-13(24)25)14(26)21-10(2-3-12(18)23)15(27)22-11(16(28)29)5-8-6-19-7-20-8/h6-7,9-11H,1-5,17H2,(H2,18,23)(H,19,20)(H,21,26)(H,22,27)(H,24,25)(H,28,29)/t9-,10-,11-/m0/s1
InChIKeyCJWANNXUTOATSJ-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)
Glu-Gln-His (CHEBI:162855) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-amino-5-[[(2S)-5-amino-1-[[(1S)-1-carboxy-2-(1H-imidazol-5-yl)ethyl]amino]-1,5-dioxopentan-2-yl]amino]-5-oxopentanoic acid