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CHEBI:161131 - Met-Trp-Cys

ChEBI IDCHEBI:161131
ChEBI NameMet-Trp-Cys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26N4O4S2
Net Charge0
Average Mass438.575
Monoisotopic Mass438.13955
SMILESCSCC[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](CS)C(=O)O
InChIInChI=1S/C19H26N4O4S2/c1-29-7-6-13(20)17(24)22-15(18(25)23-16(10-28)19(26)27)8-11-9-21-14-5-3-2-4-12(11)14/h2-5,9,13,15-16,21,28H,6-8,10,20H2,1H3,(H,22,24)(H,23,25)(H,26,27)/t13-,15-,16-/m0/s1
InChIKeySGWDZVVIRDOXSG-BPUTZDHNSA-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)
Met-Trp-Cys (CHEBI:161131) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2R)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-sulanylpropanoic acid