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CHEBI:166238 - Val-Ile-Gln

ChEBI IDCHEBI:166238
ChEBI NameVal-Ile-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H30N4O5
Net Charge0
Average Mass358.439
Monoisotopic Mass358.22162
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C16H30N4O5/c1-5-9(4)13(20-14(22)12(18)8(2)3)15(23)19-10(16(24)25)6-7-11(17)21/h8-10,12-13H,5-7,18H2,1-4H3,(H2,17,21)(H,19,23)(H,20,22)(H,24,25)/t9-,10-,12-,13-/m0/s1
InChIKeyWNZSAUMKZQXHNC-UKJIMTQDSA-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-Ile-Gln (CHEBI:166238) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S,3S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-methylpentanoyl]amino]-5-oxopentanoic acid