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CHEBI:162635 - Pro-Ser-Ile

ChEBI IDCHEBI:162635
ChEBI NamePro-Ser-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H25N3O5
Net Charge0
Average Mass315.370
Monoisotopic Mass315.17942
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)O
InChIInChI=1S/C14H25N3O5/c1-3-8(2)11(14(21)22)17-13(20)10(7-18)16-12(19)9-5-4-6-15-9/h8-11,15,18H,3-7H2,1-2H3,(H,16,19)(H,17,20)(H,21,22)/t8-,9-,10-,11-/m0/s1
InChIKeyITUDDXVFGFEKPD-NAKRPEOUSA-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)
Pro-Ser-Ile (CHEBI:162635) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-3-hydroxy-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]-3-methylpentanoic acid