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CHEBI:159658 - Asn-Cys-Met

ChEBI IDCHEBI:159658
ChEBI NameAsn-Cys-Met
Stars
Last Modified20 March 2025
SubmitterMetaboLights
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FormulaC12H22N4O5S2
Net Charge0
Average Mass366.465
Monoisotopic Mass366.10316
SMILESCSCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](N)CC(N)=O)C(=O)O
InChIInChI=1S/C12H22N4O5S2/c1-23-3-2-7(12(20)21)15-11(19)8(5-22)16-10(18)6(13)4-9(14)17/h6-8,22H,2-5,13H2,1H3,(H2,14,17)(H,15,19)(H,16,18)(H,20,21)/t6-,7-,8-/m0/s1
InChIKeyDHVMIHWNDBFTHB-FXQIFTODSA-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-Cys-Met (CHEBI:159658) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2R)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-3-sulanylpropanoyl]amino]-4-methylsulanylbutanoic acid