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CHEBI:164581 - His-Ile-Thr

ChEBI IDCHEBI:164581
ChEBI NameHis-Ile-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H27N5O5
Net Charge0
Average Mass369.422
Monoisotopic Mass369.20122
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1cncn1)C(=O)N[C@H](C(=O)O)[C@@H](C)O
InChIInChI=1S/C16H27N5O5/c1-4-8(2)12(15(24)21-13(9(3)22)16(25)26)20-14(23)11(17)5-10-6-18-7-19-10/h6-9,11-13,22H,4-5,17H2,1-3H3,(H,18,19)(H,20,23)(H,21,24)(H,25,26)/t8-,9+,11-,12-,13-/m0/s1
InChIKeyZRSJXIKQXUGKRB-TUBUOCAGSA-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-Ile-Thr (CHEBI:164581) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2S,3S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-methylpentanoyl]amino]-3-hydroxybutanoic acid