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CHEBI:158272 - Ile-Asp-Met

ChEBI IDCHEBI:158272
ChEBI NameIle-Asp-Met
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Last Modified20 March 2025
SubmitterMetaboLights
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FormulaC15H27N3O6S
Net Charge0
Average Mass377.463
Monoisotopic Mass377.16206
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCSC)C(=O)O
InChIInChI=1S/C15H27N3O6S/c1-4-8(2)12(16)14(22)18-10(7-11(19)20)13(21)17-9(15(23)24)5-6-25-3/h8-10,12H,4-7,16H2,1-3H3,(H,17,21)(H,18,22)(H,19,20)(H,23,24)/t8-,9-,10-,12-/m0/s1
InChIKeyCCHSQWLCOOZREA-GMOBBJLQSA-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-Asp-Met (CHEBI:158272) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-[[(1S)-1-carboxy-3-methylsulanylpropyl]amino]-4-oxobutanoic acid