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CHEBI:159973 - Asn-Met-Ile

ChEBI IDCHEBI:159973
ChEBI NameAsn-Met-Ile
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](CCSC)NC(=O)[C@@H](N)CC(N)=O)C(=O)O
InChIInChI=1S/C15H28N4O5S/c1-4-8(2)12(15(23)24)19-14(22)10(5-6-25-3)18-13(21)9(16)7-11(17)20/h8-10,12H,4-7,16H2,1-3H3,(H2,17,20)(H,18,21)(H,19,22)(H,23,24)/t8-,9-,10-,12-/m0/s1
InChIKeyKSGAFDTYQPKUAP-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)
Asn-Met-Ile (CHEBI:159973) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-4-methylsulanylbutanoyl]amino]-3-methylpentanoic acid