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CHEBI:158634 - Ile-Met-Met

ChEBI IDCHEBI:158634
ChEBI NameIle-Met-Met
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H31N3O4S2
Net Charge0
Average Mass393.575
Monoisotopic Mass393.17560
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)O
InChIInChI=1S/C16H31N3O4S2/c1-5-10(2)13(17)15(21)18-11(6-8-24-3)14(20)19-12(16(22)23)7-9-25-4/h10-13H,5-9,17H2,1-4H3,(H,18,21)(H,19,20)(H,22,23)/t10-,11-,12-,13-/m0/s1
InChIKeyAYLAAGNJNVZDPY-CYDGBPFRSA-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-Met (CHEBI:158634) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-methylsulanylbutanoyl]amino]-4-methylsulanylbutanoic acid