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CHEBI:158612 - Ile-Met-Arg

ChEBI IDCHEBI:158612
ChEBI NameIle-Met-Arg
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H34N6O4S
Net Charge0
Average Mass418.564
Monoisotopic Mass418.23622
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O
InChIInChI=1S/C17H34N6O4S/c1-4-10(2)13(18)15(25)22-11(7-9-28-3)14(24)23-12(16(26)27)6-5-8-21-17(19)20/h10-13H,4-9,18H2,1-3H3,(H,22,25)(H,23,24)(H,26,27)(H4,19,20,21)/t10-,11-,12-,13-/m0/s1
InChIKeyUFRXVQGGPNSJRY-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-Arg (CHEBI:158612) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-methylsulanylbutanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Manual XrefsDatabases
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