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CHEBI:158324 - Ile-Cys-Tyr

ChEBI IDCHEBI:158324
ChEBI NameIle-Cys-Tyr
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H27N3O5S
Net Charge0
Average Mass397.497
Monoisotopic Mass397.16714
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C18H27N3O5S/c1-3-10(2)15(19)17(24)21-14(9-27)16(23)20-13(18(25)26)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
InChIKeyVCYVLFAWCJRXFT-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)
Ile-Cys-Tyr (CHEBI:158324) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2R)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-sulanylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid