1.0 2010-04-08 22:10:31 UTC 2025-11-18 23:41:16 UTC FDB013093 psi-Pelletierine Found in bark of pomegranate (Punica granatum) .psi.-pelletierine 3-Granataninone, 9-methyl- 9-Azabicyclo(3.3.1)nonan-3-one, 9-methyl- 9-Azabicyclo[3.3.1]nonan-3-one, 9-methyl- 9-Methyl-3-granataninone 9-Methyl-3-granatanone 9-Methyl-9-azabicyclo(3.3.1)nonan-3-one 9-Methyl-9-azabicyclo[3.3.1]nonan-3-one 9-Methyl-9-azabicyclo[3.3.1]nonan-3-one, 9CI Granatan-3-one N-Methylgranatonine Pseudopelletierin Pseudopelletierine Pseudopelletrierin Pseudopunicine Psi-pelletierine Y-Pelletierine C9H15NO 153.2215 153.115364107 9-methyl-9-azabicyclo[3.3.1]nonan-3-one pseudopelletierine 552-70-5 CN1C2CCCC1CC(=O)C2 InChI=1S/C9H15NO/c1-10-7-3-2-4-8(10)6-9(11)5-7/h7-8H,2-6H2,1H3 RHWSKVCZXBAWLZ-UHFFFAOYSA-N belongs to the class of organic compounds known as piperidinones. Piperidinones are compounds containing a piperidine ring which bears a ketone. Piperidinones Organic compounds Organoheterocyclic compounds Piperidines Piperidinones Aliphatic heteropolycyclic compounds Azacyclic compounds Cyclic ketones Hydrocarbon derivatives Organic oxides Organopnictogen compounds Trialkylamines Aliphatic heteropolycyclic compound Amine Azacycle Carbonyl group Cyclic ketone Hydrocarbon derivative Ketone Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Piperidinone Tertiary aliphatic amine Tertiary amine Piperidine alkaloids Tropane alkaloids logp 1.00 ALOGPS logs 0.26 ALOGPS solubility 2.79e+02 g/l ALOGPS melting_point Mp 62-64° logp 1.14 ChemAxon pka_strongest_acidic 18.05 ChemAxon pka_strongest_basic 7.5 ChemAxon iupac 9-methyl-9-azabicyclo[3.3.1]nonan-3-one ChemAxon average_mass 153.2215 ChemAxon mono_mass 153.115364107 ChemAxon smiles CN1C2CCCC1CC(=O)C2 ChemAxon formula C9H15NO ChemAxon inchi InChI=1S/C9H15NO/c1-10-7-3-2-4-8(10)6-9(11)5-7/h7-8H,2-6H2,1H3 ChemAxon inchikey RHWSKVCZXBAWLZ-UHFFFAOYSA-N ChemAxon polar_surface_area 20.31 ChemAxon refractivity 43.95 ChemAxon polarizability 17.11 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13256 Specdb::CMs 131105 Specdb::CMs 138839 Specdb::MsMs 44763 Specdb::MsMs 44764 Specdb::MsMs 44765 Specdb::MsMs 137946 Specdb::MsMs 137947 Specdb::MsMs 137948 Specdb::MsMs 446772 Specdb::MsMs 446773 Specdb::MsMs 446774 Specdb::MsMs 446775 Specdb::MsMs 446776 Specdb::MsMs 2818917 Specdb::MsMs 2818918 Specdb::MsMs 2818919 Specdb::MsMs 2890456 Specdb::MsMs 2890457 Specdb::MsMs 2890458 HMDB34580 #<Reference:0x000055ce32f8c310> Fruits Unknown generic Pomegranate Type 1 specific Punica granatum 22663