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CHEBI:161991 - Gln-Asp-Gln

ChEBI IDCHEBI:161991
ChEBI NameGln-Asp-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H23N5O8
Net Charge0
Average Mass389.365
Monoisotopic Mass389.15466
SMILESNC(=O)CC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O
InChIInChI=1S/C14H23N5O8/c15-6(1-3-9(16)20)12(24)19-8(5-11(22)23)13(25)18-7(14(26)27)2-4-10(17)21/h6-8H,1-5,15H2,(H2,16,20)(H2,17,21)(H,18,25)(H,19,24)(H,22,23)(H,26,27)/t6-,7-,8-/m0/s1
InChIKeyRKAQZCDMSUQTSS-FXQIFTODSA-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)
Gln-Asp-Gln (CHEBI:161991) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-3-carboxy-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]propanoyl]amino]-5-oxopentanoic acid