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CHEBI:160879 - Met-Leu-Trp

Default Structure
ChEBI IDCHEBI:160879
ChEBI NameMet-Leu-Trp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H32N4O4S
Net Charge0
Average Mass448.589
Monoisotopic Mass448.21443
SMILESCSCC[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C22H32N4O4S/c1-13(2)10-18(25-20(27)16(23)8-9-31-3)21(28)26-19(22(29)30)11-14-12-24-17-7-5-4-6-15(14)17/h4-7,12-13,16,18-19,24H,8-11,23H2,1-3H3,(H,25,27)(H,26,28)(H,29,30)/t16-,18-,19-/m0/s1
InChIKeyOCRSGGIJBDUXHU-WDSOQIARSA-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-Leu-Trp (CHEBI:160879) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-4-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
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