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CHEBI:164312 - Thr-Trp-Trp

ChEBI IDCHEBI:164312
ChEBI NameThr-Trp-Trp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H29N5O5
Net Charge0
Average Mass491.548
Monoisotopic Mass491.21687
SMILESC[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C26H29N5O5/c1-14(32)23(27)25(34)30-21(10-15-12-28-19-8-4-2-6-17(15)19)24(33)31-22(26(35)36)11-16-13-29-20-9-5-3-7-18(16)20/h2-9,12-14,21-23,28-29,32H,10-11,27H2,1H3,(H,30,34)(H,31,33)(H,35,36)/t14-,21+,22+,23+/m1/s1
InChIKeyBGHVVGPELPHRCI-HZTRNQAASA-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-Trp (CHEBI:164312) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoic acid