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CHEBI:160810 - Met-Ile-Asn

ChEBI IDCHEBI:160810
ChEBI NameMet-Ile-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H28N4O5S
Net Charge0
Average Mass376.479
Monoisotopic Mass376.17804
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)O
InChIInChI=1S/C15H28N4O5S/c1-4-8(2)12(19-13(21)9(16)5-6-25-3)14(22)18-10(15(23)24)7-11(17)20/h8-10,12H,4-7,16H2,1-3H3,(H2,17,20)(H,18,22)(H,19,21)(H,23,24)/t8-,9-,10-,12-/m0/s1
InChIKeyDJBCKVNHEIJLQA-GMOBBJLQSA-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)
Met-Ile-Asn (CHEBI:160810) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[(2S,3S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-methylpentanoyl]amino]-4-oxobutanoic acid