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CHEBI:166053 - Tyr-Val-Tyr

ChEBI IDCHEBI:166053
ChEBI NameTyr-Val-Tyr
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Last Modified20 March 2025
SubmitterMetaboLights
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FormulaC23H29N3O6
Net Charge0
Average Mass443.500
Monoisotopic Mass443.20564
SMILESCC(C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C23H29N3O6/c1-13(2)20(26-21(29)18(24)11-14-3-7-16(27)8-4-14)22(30)25-19(23(31)32)12-15-5-9-17(28)10-6-15/h3-10,13,18-20,27-28H,11-12,24H2,1-2H3,(H,25,30)(H,26,29)(H,31,32)/t18-,19-,20-/m0/s1
InChIKeyYKBUNNNRNZZUID-UFYCRDLUSA-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-Val-Tyr (CHEBI:166053) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid