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CHEBI:158758 - Ile-Ser-Ser

ChEBI IDCHEBI:158758
ChEBI NameIle-Ser-Ser
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H23N3O6
Net Charge0
Average Mass305.331
Monoisotopic Mass305.15869
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O
InChIInChI=1S/C12H23N3O6/c1-3-6(2)9(13)11(19)14-7(4-16)10(18)15-8(5-17)12(20)21/h6-9,16-17H,3-5,13H2,1-2H3,(H,14,19)(H,15,18)(H,20,21)/t6-,7-,8-,9-/m0/s1
InChIKeyPXKACEXYLPBMAD-JBDRJPRFSA-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-Ser-Ser (CHEBI:158758) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxypropanoic acid