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CHEBI:161190 - Cys-Asp-Asn

ChEBI IDCHEBI:161190
ChEBI NameCys-Asp-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H18N4O7S
Net Charge0
Average Mass350.353
Monoisotopic Mass350.08962
SMILESNC(=O)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CS)C(=O)O
InChIInChI=1S/C11H18N4O7S/c12-4(3-23)9(19)14-5(2-8(17)18)10(20)15-6(11(21)22)1-7(13)16/h4-6,23H,1-3,12H2,(H2,13,16)(H,14,19)(H,15,20)(H,17,18)(H,21,22)/t4-,5-,6-/m0/s1
InChIKeyUWXFFVQPAMBETM-ZLUOBGJFSA-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)
Cys-Asp-Asn (CHEBI:161190) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-3-carboxypropanoyl]amino]-4-oxobutanoic acid