RefMet Compound Details

MW structure51673 (View MW Metabolite Database details)
RefMet nameNornicotine
Systematic name3-[(2S)-pyrrolidin-2-yl]pyridine
SMILESc1cc(cnc1)[C@@H]1CCCN1   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass148.100048 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC9H12N2View other entries in RefMet with this formula
InChIKeyMYKUKUCHPMASKF-VIFPVBQESA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassAlkaloids
Main ClassPyridine alkaloids
Sub ClassNicotinic acid alkaloids
Pubchem CID91462
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)