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CHEBI:161799 - Cys-Tyr-Ile

ChEBI IDCHEBI:161799
ChEBI NameCys-Tyr-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H27N3O5S
Net Charge0
Average Mass397.497
Monoisotopic Mass397.16714
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CS)C(=O)O
InChIInChI=1S/C18H27N3O5S/c1-3-10(2)15(18(25)26)21-17(24)14(20-16(23)13(19)9-27)8-11-4-6-12(22)7-5-11/h4-7,10,13-15,22,27H,3,8-9,19H2,1-2H3,(H,20,23)(H,21,24)(H,25,26)/t10-,13-,14-,15-/m0/s1
InChIKeyZFHXNNXMNLWKJH-HJPIBITLSA-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)
Cys-Tyr-Ile (CHEBI:161799) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoic acid