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CHEBI:164289 - Thr-Trp-Gln

ChEBI IDCHEBI:164289
ChEBI NameThr-Trp-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H27N5O6
Net Charge0
Average Mass433.465
Monoisotopic Mass433.19613
SMILESC[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C20H27N5O6/c1-10(26)17(22)19(29)25-15(8-11-9-23-13-5-3-2-4-12(11)13)18(28)24-14(20(30)31)6-7-16(21)27/h2-5,9-10,14-15,17,23,26H,6-8,22H2,1H3,(H2,21,27)(H,24,28)(H,25,29)(H,30,31)/t10-,14+,15+,17+/m1/s1
InChIKeySOUPNXUJAJENFU-SWRJLBSHSA-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-Trp-Gln (CHEBI:164289) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-5-oxopentanoic acid