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CHEBI:158642 - Ile-Met-Thr

ChEBI IDCHEBI:158642
ChEBI NameIle-Met-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H29N3O5S
Net Charge0
Average Mass363.480
Monoisotopic Mass363.18279
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)[C@@H](C)O
InChIInChI=1S/C15H29N3O5S/c1-5-8(2)11(16)14(21)17-10(6-7-24-4)13(20)18-12(9(3)19)15(22)23/h8-12,19H,5-7,16H2,1-4H3,(H,17,21)(H,18,20)(H,22,23)/t8-,9+,10-,11-,12-/m0/s1
InChIKeyBKPPWVSPSIUXHZ-OSUNSFLBSA-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-Met-Thr (CHEBI:158642) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-methylsulanylbutanoyl]amino]-3-hydroxybutanoic acid