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CHEBI:181846 - N-Acetylcytisine

ChEBI IDCHEBI:181846
ChEBI NameN-Acetylcytisine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H16N2O2
Net Charge0
Average Mass232.283
Monoisotopic Mass232.12118
SMILESCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
InChIInChI=1S/C13H16N2O2/c1-9(16)14-6-10-5-11(8-14)12-3-2-4-13(17)15(12)7-10/h2-4,10-11H,5-8H2,1H3
InChIKeyWCRIKJOQMRFVPX-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
N-Acetylcytisine (CHEBI:181846) is a alkaloid (CHEBI:22315)
IUPAC Name 
11-acetyl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
Manual XrefsDatabases
2947995ChemSpider