quinine
AlkaPlorer ID: AK000048
Synonym: 'Pitayine', '', 'Chinine', '(R)-(6-methoxyquinolin-4-yl)((2S,4S,8R)-8-vinylquinuclidin-2-yl)methanol', 'Quinine, hydrobromide, hydrate\n4-Quinolinemethanol, 6-methoxy-.alpha.-5-vinyl-2-quinuclidinyl hydrobromide', "6'-Methoxycinchonidine", 'Chinidin', 'Cin-quin', 'chininum', '(+)-Quinidine', 'Conchinine', 'MLSMR', '(R)-(-)-quinine', '(8S,9R)-quinine', '(-)-quinine', 'MLS002638287', '(-)-Quinine', 'chinine', 'Quinine', 'Kinidin', 'Chinin', "6'-methoxycinchonidine", 'quinina', 'quinine', 'Quinidine', '(6-methoxy-4-quinolyl)-(5-vinylquinuclidin-2-yl)methanol', 'SMR001547776', 'Quinine, hydrobromide, hydrate', 'Quinindine', 'Conquinine'
IUPAC Name: (R)-[(2S,4R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
Structure
SMILES: C=C[C@H]1C[N@]2CC[C@@H]1C[C@H]2[C@H](O)C1=CC=NC2=CC=C(OC)C=C12
InChI: InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14+,19-,20+/m0/s1
InChIKey: LOUPRKONTZGTKE-FOEVPDMQSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cinchona calisaya | Cinchona | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 324.4240000000001
TPSA？: 45.59
MolLogP？: 3.1732000000000014
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|