EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:165914 - Tyr-Met-Val

ChEBI IDCHEBI:165914
ChEBI NameTyr-Met-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H29N3O5S
Net Charge0
Average Mass411.524
Monoisotopic Mass411.18279
SMILESCSCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)C(C)C
InChIInChI=1S/C19H29N3O5S/c1-11(2)16(19(26)27)22-18(25)15(8-9-28-3)21-17(24)14(20)10-12-4-6-13(23)7-5-12/h4-7,11,14-16,23H,8-10,20H2,1-3H3,(H,21,24)(H,22,25)(H,26,27)/t14-,15-,16-/m0/s1
InChIKeyKHUVIWRRFMPVHD-JYJNAYRXSA-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-Met-Val (CHEBI:165914) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylsulanylbutanoyl]amino]-3-methylbutanoic acid