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CHEBI:158267 - Ala-Ile-Met

ChEBI IDCHEBI:158267
ChEBI NameAla-Ile-Met
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Last Modified20 March 2025
SubmitterMetaboLights
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FormulaC14H27N3O4S
Net Charge0
Average Mass333.454
Monoisotopic Mass333.17223
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](CCSC)C(=O)O
InChIInChI=1S/C14H27N3O4S/c1-5-8(2)11(17-12(18)9(3)15)13(19)16-10(14(20)21)6-7-22-4/h8-11H,5-7,15H2,1-4H3,(H,16,19)(H,17,18)(H,20,21)/t8-,9-,10-,11-/m0/s1
InChIKeyXCZXVTHYGSMQGH-NAKRPEOUSA-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)
Ala-Ile-Met (CHEBI:158267) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3S)-2-[[(2S)-2-aminopropanoyl]amino]-3-methylpentanoyl]amino]-4-methylsulanylbutanoic acid