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CHEBI:166318 - Val-Phe-Asp

ChEBI IDCHEBI:166318
ChEBI NameVal-Phe-Asp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H25N3O6
Net Charge0
Average Mass379.413
Monoisotopic Mass379.17434
SMILESCC(C)[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O
InChIInChI=1S/C18H25N3O6/c1-10(2)15(19)17(25)20-12(8-11-6-4-3-5-7-11)16(24)21-13(18(26)27)9-14(22)23/h3-7,10,12-13,15H,8-9,19H2,1-2H3,(H,20,25)(H,21,24)(H,22,23)(H,26,27)/t12-,13-,15-/m0/s1
InChIKeyWMRWZYSRQUORHJ-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)
Val-Phe-Asp (CHEBI:166318) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]butanedioic acid