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CHEBI:136830 - S-[(Z)-N-hydroxy-2-phenylethanimidoyl]-L-cysteinylglycine zwitterion

ChEBI IDCHEBI:136830
ChEBI NameS-[(Z)-N-hydroxy-2-phenylethanimidoyl]-L-cysteinylglycine zwitterion
Stars
ASCII NameS-[(Z)-N-hydroxy-2-phenylethanimidoyl]-L-cysteinylglycine zwitterion
DefinitionA dipeptide zwitterion resulting from transfer of a proton from the carboxy to the amino group of S-[(Z)-N-hydroxy-2-phenylethanimidoyl]-L-cysteinylglycine; major species at pH 7.3.
Last Modified28 September 2017
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC13H17N3O4S
Net Charge0
Average Mass311.363
Monoisotopic Mass311.09398
SMILES[NH3+][C@@H](CS/C(Cc1ccccc1)=N\O)C(=O)NCC(=O)[O-]
InChIInChI=1S/C13H17N3O4S/c14-10(13(19)15-7-12(17)18)8-21-11(16-20)6-9-4-2-1-3-5-9/h1-5,10,20H,6-8,14H2,(H,15,19)(H,17,18)/b16-11-/t10-/m0/s1
InChIKeyFRNQPMDCZLCKPZ-WSJCWXPMSA-N
ChEBI Ontology
Outgoing Relation(s)
S-[(Z)-N-hydroxy-2-phenylethanimidoyl]-L-cysteinylglycine zwitterion (CHEBI:136830) is a dipeptide zwitterion (CHEBI:90799)
S-[(Z)-N-hydroxy-2-phenylethanimidoyl]-L-cysteinylglycine zwitterion (CHEBI:136830) is tautomer of S-[(Z)-N-hydroxy-2-phenylethanimidoyl]-L-cysteinylglycine (CHEBI:137669)
Incoming Relation(s)
S-[(Z)-N-hydroxy-2-phenylethanimidoyl]-L-cysteinylglycine (CHEBI:137669) is tautomer of S-[(Z)-N-hydroxy-2-phenylethanimidoyl]-L-cysteinylglycine zwitterion (CHEBI:136830)
IUPAC Name 
{[(2R)-2-azaniumyl-3-{[(1E)-N-hydroxy-2-phenylethanimidoyl]sulfanyl}propanoyl]amino}acetate
Synonym  Source
phenylacetohydroximoyl-cysteinylglycine zwitterionChEBI
UniProt Name  Source
(Z)-1-(glycyl-L-cystein-S-yl)-2-phenylacetohydroximateUniProt
Manual XrefsDatabases
CPD-12385MetaCyc