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CHEBI:158124 - His-Val-Val

ChEBI IDCHEBI:158124
ChEBI NameHis-Val-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H27N5O4
Net Charge0
Average Mass353.423
Monoisotopic Mass353.20630
SMILESCC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1cncn1)C(C)C)C(=O)O
InChIInChI=1S/C16H27N5O4/c1-8(2)12(15(23)21-13(9(3)4)16(24)25)20-14(22)11(17)5-10-6-18-7-19-10/h6-9,11-13H,5,17H2,1-4H3,(H,18,19)(H,20,22)(H,21,23)(H,24,25)/t11-,12-,13-/m0/s1
InChIKeyDRKZDEFADVYTLU-AVGNSLFASA-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)
His-Val-Val (CHEBI:158124) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoic acid