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CHEBI:164950 - Tyr-Ala-Tyr

ChEBI IDCHEBI:164950
ChEBI NameTyr-Ala-Tyr
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H25N3O6
Net Charge0
Average Mass415.446
Monoisotopic Mass415.17434
SMILESC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C21H25N3O6/c1-12(23-20(28)17(22)10-13-2-6-15(25)7-3-13)19(27)24-18(21(29)30)11-14-4-8-16(26)9-5-14/h2-9,12,17-18,25-26H,10-11,22H2,1H3,(H,23,28)(H,24,27)(H,29,30)/t12-,17-,18-/m0/s1
InChIKeyKSVMDJJCYKIXTK-IGNZVWTISA-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)
Tyr-Ala-Tyr (CHEBI:164950) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid