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CHEBI:166218 - Val-His-Gln

Default Structure
ChEBI IDCHEBI:166218
ChEBI NameVal-His-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H26N6O5
Net Charge0
Average Mass382.421
Monoisotopic Mass382.19647
SMILESCC(C)[C@H](N)C(=O)N[C@@H](Cc1cncn1)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C16H26N6O5/c1-8(2)13(18)15(25)22-11(5-9-6-19-7-20-9)14(24)21-10(16(26)27)3-4-12(17)23/h6-8,10-11,13H,3-5,18H2,1-2H3,(H2,17,23)(H,19,20)(H,21,24)(H,22,25)(H,26,27)/t10-,11-,13-/m0/s1
InChIKeySDSCOOZQQGUQFC-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)
Val-His-Gln (CHEBI:166218) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-5-oxopentanoic acid