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CHEBI:161720 - Phe-Met-Cys

ChEBI IDCHEBI:161720
ChEBI NamePhe-Met-Cys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H25N3O4S2
Net Charge0
Average Mass399.538
Monoisotopic Mass399.12865
SMILESCSCC[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)O
InChIInChI=1S/C17H25N3O4S2/c1-26-8-7-13(16(22)20-14(10-25)17(23)24)19-15(21)12(18)9-11-5-3-2-4-6-11/h2-6,12-14,25H,7-10,18H2,1H3,(H,19,21)(H,20,22)(H,23,24)/t12-,13-,14-/m0/s1
InChIKeyVHDNDCPMHQMXIR-IHRRRGAJSA-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)
Phe-Met-Cys (CHEBI:161720) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2R)-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-4-methylsulanylbutanoyl]amino]-3-sulanylpropanoic acid