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CHEBI:160422 - Lys-Val-Gln

Default Structure
ChEBI IDCHEBI:160422
ChEBI NameLys-Val-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H31N5O5
Net Charge0
Average Mass373.454
Monoisotopic Mass373.23252
SMILESCC(C)[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C16H31N5O5/c1-9(2)13(21-14(23)10(18)5-3-4-8-17)15(24)20-11(16(25)26)6-7-12(19)22/h9-11,13H,3-8,17-18H2,1-2H3,(H2,19,22)(H,20,24)(H,21,23)(H,25,26)/t10-,11-,13-/m0/s1
InChIKeyXABXVVSWUVCZST-GVXVVHGQSA-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)
Lys-Val-Gln (CHEBI:160422) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-methylbutanoyl]amino]-5-oxopentanoic acid