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CHEBI:164122 - Thr-Met-Trp

ChEBI IDCHEBI:164122
ChEBI NameThr-Met-Trp
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Last Modified20 March 2025
SubmitterMetaboLights
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FormulaC20H28N4O5S
Net Charge0
Average Mass436.534
Monoisotopic Mass436.17804
SMILESCSCC[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C20H28N4O5S/c1-11(25)17(21)19(27)23-15(7-8-30-2)18(26)24-16(20(28)29)9-12-10-22-14-6-4-3-5-13(12)14/h3-6,10-11,15-17,22,25H,7-9,21H2,1-2H3,(H,23,27)(H,24,26)(H,28,29)/t11-,15+,16+,17+/m1/s1
InChIKeyGIBPOCDKBPNRJB-HSHDSVGOSA-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)
Thr-Met-Trp (CHEBI:164122) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-4-methylsulanylbutanoyl]amino]-3-(1H-indol-3-yl)propanoic acid