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CHEBI:160720 - Met-Glu-Trp

Default Structure
ChEBI IDCHEBI:160720
ChEBI NameMet-Glu-Trp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28N4O6S
Net Charge0
Average Mass464.544
Monoisotopic Mass464.17296
SMILESCSCC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C21H28N4O6S/c1-32-9-8-14(22)19(28)24-16(6-7-18(26)27)20(29)25-17(21(30)31)10-12-11-23-15-5-3-2-4-13(12)15/h2-5,11,14,16-17,23H,6-10,22H2,1H3,(H,24,28)(H,25,29)(H,26,27)(H,30,31)/t14-,16-,17-/m0/s1
InChIKeyYAWKHFKCNSXYDS-XIRDDKMYSA-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-Glu-Trp (CHEBI:160720) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-5-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-5-oxopentanoic acid