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CHEBI:158562 - Ile-Leu-Thr

ChEBI IDCHEBI:158562
ChEBI NameIle-Leu-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H31N3O5
Net Charge0
Average Mass345.440
Monoisotopic Mass345.22637
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O
InChIInChI=1S/C16H31N3O5/c1-6-9(4)12(17)15(22)18-11(7-8(2)3)14(21)19-13(10(5)20)16(23)24/h8-13,20H,6-7,17H2,1-5H3,(H,18,22)(H,19,21)(H,23,24)/t9-,10+,11-,12-,13-/m0/s1
InChIKeyPHRWFSFCNJPWRO-PPCPHDFISA-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)
Ile-Leu-Thr (CHEBI:158562) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoic acid