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CHEBI:164285 - Thr-Trp-Asn

Default Structure
ChEBI IDCHEBI:164285
ChEBI NameThr-Trp-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H25N5O6
Net Charge0
Average Mass419.438
Monoisotopic Mass419.18048
SMILESC[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)O
InChIInChI=1S/C19H25N5O6/c1-9(25)16(21)18(28)23-13(17(27)24-14(19(29)30)7-15(20)26)6-10-8-22-12-5-3-2-4-11(10)12/h2-5,8-9,13-14,16,22,25H,6-7,21H2,1H3,(H2,20,26)(H,23,28)(H,24,27)(H,29,30)/t9-,13+,14+,16+/m1/s1
InChIKeyBJJRNAVDQGREGC-HOUAVDHOSA-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-Asn (CHEBI:164285) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-oxobutanoic acid