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CHEBI:158873 - Ile-Tyr-Met

ChEBI IDCHEBI:158873
ChEBI NameIle-Tyr-Met
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H31N3O5S
Net Charge0
Average Mass425.551
Monoisotopic Mass425.19844
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCSC)C(=O)O
InChIInChI=1S/C20H31N3O5S/c1-4-12(2)17(21)19(26)23-16(11-13-5-7-14(24)8-6-13)18(25)22-15(20(27)28)9-10-29-3/h5-8,12,15-17,24H,4,9-11,21H2,1-3H3,(H,22,25)(H,23,26)(H,27,28)/t12-,15-,16-,17-/m0/s1
InChIKeyHODVZHLJUUWPKY-STECZYCISA-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-Tyr-Met (CHEBI:158873) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylsulanylbutanoic acid
Manual XrefsDatabases
9684932ChemSpider