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CHEBI:746958 - benzothiazolylcysteine zwitterion

Default Structure
ChEBI IDCHEBI:746958
ChEBI Namebenzothiazolylcysteine zwitterion
Stars
DefinitionMajor species at pH 7.3 (predicted).
Last Modified30 November 2025
SubmitterR. Stephan
DownloadsMolfile
FormulaC10H10N2O2S2
Net Charge0
Average Mass254.336
Monoisotopic Mass254.01837
SMILES[NH3+]C(CSc1nc2ccccc2s1)C(=O)[O-]
InChIInChI=1S/C10H10N2O2S2/c11-6(9(13)14)5-15-10-12-7-3-1-2-4-8(7)16-10/h1-4,6H,5,11H2,(H,13,14)
InChIKeyKRBPTLCTECPKGY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
benzothiazolylcysteine zwitterion (CHEBI:746958) is a organic molecular entity (CHEBI:50860)
Synonym  Source
BTCPubChem Compound
Citations