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CHEBI:162531 - Pro-Met-Trp

ChEBI IDCHEBI:162531
ChEBI NamePro-Met-Trp
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28N4O4S
Net Charge0
Average Mass432.546
Monoisotopic Mass432.18313
SMILESCSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C21H28N4O4S/c1-30-10-8-17(24-19(26)16-7-4-9-22-16)20(27)25-18(21(28)29)11-13-12-23-15-6-3-2-5-14(13)15/h2-3,5-6,12,16-18,22-23H,4,7-11H2,1H3,(H,24,26)(H,25,27)(H,28,29)/t16-,17-,18-/m0/s1
InChIKeyBGGWNVWMHNTRDU-BZSNNMDCSA-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)
Pro-Met-Trp (CHEBI:162531) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-3-(1H-indol-3-yl)-2-[[(2S)-4-methylsulanyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]butanoyl]amino]propanoic acid