Cernuine

(1S,7S,9R,11S,13S)-11-methyl-2,17-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-3-one

Also Known As: Cernuine|12-Deoxylycocernuine|NP0865|TN6307|(1S,7S,9R,11S,13S)-11-methyl-2,17-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-3-one|(1S,7S,9R,11S,13S)-11-methyl-2,17-diazatetracyclo(7.7.1.02,7.013,17)heptadecan-3-one|(3aS)-1,2,3,3a,4,5,6,6abeta,7,7abeta,8,9,10,12aalpha-Tetradecahydro-5alpha-methyl-11H-pyrido[1 ,2 :3,4]pyrimido[2,1,6-de]quinolizin-11-one|(3aS,5S,6aR,7aS,12aS)-5-Methyltetradecahydro-11H-pyrido[1',2':3,4]pyrimido[2,1,6-de]quinolizin-11-one|(3aS,5S,6aR,7aS,12aS)-Tetradecahydro-5-methyl-11H-pyrido(1',2':3,4)pyrimido(2,1,6-de)quinolizin-11-one|(3aS,5S,6aR,7aS,12aS)-Tetradecahydro-5-methyl-11H-pyrido[1 inverted exclamation marka,2 inverted exclamation marka:3,4]pyrimido[2,1,6-de]quinolizin-11-one

Molecular Formula	C16H26N2O
Molecular Weight	262.2045 g/mol
LogP	2.8
Topological Polar Surface Area	23.6 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	0
Exact Mass	262.2045
Monoisotopic Mass	262.2045
Heavy Atoms	19
Complexity	383.0

Chemical Identifiers

CAS Number	6880-84-8
SMILES	C[C@H]1C[C@@H]2CCC[C@H]3N2[C@H](C1)C[C@H]4N3C(=O)CCC4
InChIKey	IWSJXTCXZSUCNS-LXFSFDBISA-N