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CHEBI:160934 - Asp-Thr-Phe

Default Structure
ChEBI IDCHEBI:160934
ChEBI NameAsp-Thr-Phe
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H23N3O7
Net Charge0
Average Mass381.385
Monoisotopic Mass381.15360
SMILESC[C@@H](O)[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C17H23N3O7/c1-9(21)14(20-15(24)11(18)8-13(22)23)16(25)19-12(17(26)27)7-10-5-3-2-4-6-10/h2-6,9,11-12,14,21H,7-8,18H2,1H3,(H,19,25)(H,20,24)(H,22,23)(H,26,27)/t9-,11+,12+,14+/m1/s1
InChIKeyGXHDGYOXPNQCKM-XVSYOHENSA-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-Thr-Phe (CHEBI:160934) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S,3R)-1-[[(1S)-1-carboxy-2-phenylethyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-4-oxobutanoic acid