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CHEBI:161025 - Asp-Tyr-Val

ChEBI IDCHEBI:161025
ChEBI NameAsp-Tyr-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H25N3O7
Net Charge0
Average Mass395.412
Monoisotopic Mass395.16925
SMILESCC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)O
InChIInChI=1S/C18H25N3O7/c1-9(2)15(18(27)28)21-17(26)13(7-10-3-5-11(22)6-4-10)20-16(25)12(19)8-14(23)24/h3-6,9,12-13,15,22H,7-8,19H2,1-2H3,(H,20,25)(H,21,26)(H,23,24)(H,27,28)/t12-,13-,15-/m0/s1
InChIKeyBYLPQJAWXJWUCJ-YDHLFZDLSA-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)
Asp-Tyr-Val (CHEBI:161025) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoic acid