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CHEBI:160817 - Asp-Phe-Ser

ChEBI IDCHEBI:160817
ChEBI NameAsp-Phe-Ser
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H21N3O7
Net Charge0
Average Mass367.358
Monoisotopic Mass367.13795
SMILESN[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O
InChIInChI=1S/C16H21N3O7/c17-10(7-13(21)22)14(23)18-11(6-9-4-2-1-3-5-9)15(24)19-12(8-20)16(25)26/h1-5,10-12,20H,6-8,17H2,(H,18,23)(H,19,24)(H,21,22)(H,25,26)/t10-,11-,12-/m0/s1
InChIKeyRPUYTJJZXQBWDT-SRVKXCTJSA-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-Phe-Ser (CHEBI:160817) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S)-1-[[(1S)-1-carboxy-2-hydroxyethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid