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CHEBI:749089 - cotinine

Default Structure
ChEBI IDCHEBI:749089
ChEBI Namecotinine
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC10H12N2O
Net Charge0
Average Mass176.219
Monoisotopic Mass176.09496
SMILESCN1C(=O)CC[C@H]1c1cccnc1
InChIInChI=1S/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1
InChIKeyUIKROCXWUNQSPJ-VIFPVBQESA-N
ChEBI Ontology
Outgoing Relation(s)
cotinine (CHEBI:749089) is a pyridines (CHEBI:26421)
cotinine (CHEBI:749089) is a pyrrolidines (CHEBI:38260)
Synonym  Source
Nicotine related compound cChEMBL
Citations