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CHEBI:161125 - Met-Trp-Ala

ChEBI IDCHEBI:161125
ChEBI NameMet-Trp-Ala
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26N4O4S
Net Charge0
Average Mass406.508
Monoisotopic Mass406.16748
SMILESCSCC[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](C)C(=O)O
InChIInChI=1S/C19H26N4O4S/c1-11(19(26)27)22-18(25)16(23-17(24)14(20)7-8-28-2)9-12-10-21-15-6-4-3-5-13(12)15/h3-6,10-11,14,16,21H,7-9,20H2,1-2H3,(H,22,25)(H,23,24)(H,26,27)/t11-,14-,16-/m0/s1
InChIKeyTUZSWDCTCGTVDJ-PJODQICGSA-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-Ala (CHEBI:161125) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]propanoic acid