1.0 2010-04-08 22:07:05 UTC 2025-11-18 23:01:33 UTC FDB006314 Dihydrocinchonine Dihydrocinchonine is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Dihydrocinchonine can be found in olive, which makes dihydrocinchonine a potential biomarker for the consumption of this food product. C19H24N2O 296.4067 296.1888634 (S)-[(2R,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl](quinolin-4-yl)methanol (S)-[(2R,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl](quinolin-4-yl)methanol CC[C@H]1CN2CCC1C[C@@H]2[C@@H](O)C1=CC=NC2=CC=CC=C12 InChI=1S/C19H24N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h3-7,9,13-14,18-19,22H,2,8,10-12H2,1H3/t13-,14?,18+,19-/m0/s1 WFJNHVWTKZUUTR-FGVBSWQGSA-N belongs to the class of organic compounds known as cinchona alkaloids. These are alkaloids structurally characterized by the presence of the cinchonan skeleton, which consists of a quinoline linked to an azabicyclo[2.2.2]octane moiety. Cinchona alkaloids Organic compounds Alkaloids and derivatives Cinchona alkaloids Aromatic heteropolycyclic compounds 1,2-aminoalcohols 4-quinolinemethanols Aralkylamines Aromatic alcohols Azacyclic compounds Benzenoids Heteroaromatic compounds Hydrocarbon derivatives Organopnictogen compounds Piperidines Pyridines and derivatives Quinuclidines Secondary alcohols Trialkylamines 1,2-aminoalcohol 4-quinolinemethanol Alcohol Amine Aralkylamine Aromatic alcohol Aromatic heteropolycyclic compound Azacycle Benzenoid Cinchonan-skeleton Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Piperidine Pyridine Quinoline Quinuclidine Secondary alcohol Tertiary aliphatic amine Tertiary amine logp 3.26 ALOGPS logs -2.96 ALOGPS solubility 3.22e-01 g/l ALOGPS logp 2.98 ChemAxon pka_strongest_acidic 13.88 ChemAxon pka_strongest_basic 9.28 ChemAxon iupac (S)-[(2R,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl](quinolin-4-yl)methanol ChemAxon average_mass 296.4067 ChemAxon mono_mass 296.1888634 ChemAxon smiles CC[C@H]1CN2CCC1C[C@@H]2[C@@H](O)C1=CC=NC2=CC=CC=C12 ChemAxon formula C19H24N2O ChemAxon inchi InChI=1S/C19H24N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h3-7,9,13-14,18-19,22H,2,8,10-12H2,1H3/t13-,14?,18+,19-/m0/s1 ChemAxon inchikey WFJNHVWTKZUUTR-FGVBSWQGSA-N ChemAxon polar_surface_area 36.36 ChemAxon refractivity 88.19 ChemAxon polarizability 33.92 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 101922 Specdb::MsMs 101923 Specdb::MsMs 101924 Specdb::MsMs 167619 Specdb::MsMs 167620 Specdb::MsMs 167621 Specdb::MsMs 3602783 Specdb::MsMs 3602784 Specdb::MsMs 3602785 Specdb::MsMs 3602786 Specdb::MsMs 3602787 Specdb::MsMs 3602788 Olive Type 1 specific Olea europaea 4146