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CHEBI:158078 - Ala-Cys-Phe

ChEBI IDCHEBI:158078
ChEBI NameAla-Cys-Phe
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Last Modified20 March 2025
SubmitterMetaboLights
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FormulaC15H21N3O4S
Net Charge0
Average Mass339.417
Monoisotopic Mass339.12528
SMILESC[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C15H21N3O4S/c1-9(16)13(19)18-12(8-23)14(20)17-11(15(21)22)7-10-5-3-2-4-6-10/h2-6,9,11-12,23H,7-8,16H2,1H3,(H,17,20)(H,18,19)(H,21,22)/t9-,11-,12-/m0/s1
InChIKeyIYCZBJXFSZSHPN-DLOVCJGASA-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)
Ala-Cys-Phe (CHEBI:158078) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2R)-2-[[(2S)-2-aminopropanoyl]amino]-3-sulanylpropanoyl]amino]-3-phenylpropanoic acid