CAS Number130-95-0
Synonyms(R)-[(2S,4S,5R)-5-éthènyl-1-azabicyclo[2.2.2]oct-2-yl](6-méthoxy-4-quinoléinyl)méthanol; (-)-Quinine; 6'-Methoxycinchonidine; Kinin; Kinidin-d3; Quinina; (R)-(6-Methoxyquinolin-4-yl)((1R,2R,4R,5S)-5-vinylquinuclidin-2-yl)methanol; chinine; MFCD00198096; (R)-(6-Methoxy-4-chinolinyl)[(2S,4S,5R)-5-vinyl-1-azabicyclo[2.2.2]oct-2-yl]methanol; (R)-(6-Methoxy-4-quinolinyl)[(2S,4S,5R)-5-vinyl-1-azabicyclo[2.2.2]oct-2-yl]methanol; Chinin; (8S,9R)-6'-Methoxycinchonan-9-ol; (R)-(-)-Quinine; EINECS 205-003-2; (8a,9R)-6'-methoxycinchonan-9-ol; QUININE; Pitayin-d3; UNII-A7V27PHC7A; (8α,9R)-6'-Methoxycinchonan-9-ol; Quinie
Molecular FormulaC20H24N2O2
Molecular Weight324.42
Purity≥98.0 (dried material, NT)%
Density1.2±0.1 g/cm3
Boiling Point495.9±40.0 °C at 760 mmHg
Melting Point173-175 °C (lit.)
Appearancepowder
EINECS205-003-2
Symbol
Signal WordWarning
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| Chemical & Physical Properties | |
|---|---|
| CAS Number | 130-95-0 |
| Catalog No. | 2A-9020659 |
| Chinese Name | 奎宁； 无水奎宁； 金鸡纳碱； 金鸡纳霜 |
| Synonyms | (R)-[(2S,4S,5R)-5-éthènyl-1-azabicyclo[2.2.2]oct-2-yl](6-méthoxy-4-quinoléinyl)méthanol; (-)-Quinine; 6'-Methoxycinchonidine; Kinin; Kinidin-d3; Quinina; (R)-(6-Methoxyquinolin-4-yl)((1R,2R,4R,5S)-5-vinylquinuclidin-2-yl)methanol; chinine; MFCD00198096; (R)-(6-Methoxy-4-chinolinyl)[(2S,4S,5R)-5-vinyl-1-azabicyclo[2.2.2]oct-2-yl]methanol; (R)-(6-Methoxy-4-quinolinyl)[(2S,4S,5R)-5-vinyl-1-azabicyclo[2.2.2]oct-2-yl]methanol; Chinin; (8S,9R)-6'-Methoxycinchonan-9-ol; (R)-(-)-Quinine; EINECS 205-003-2; (8a,9R)-6'-methoxycinchonan-9-ol; QUININE; Pitayin-d3; UNII-A7V27PHC7A; (8α,9R)-6'-Methoxycinchonan-9-ol; Quinie |
| Molecular Formula | C20H24N2O2 |
| Molecular Weight | 324.42 |
| Purity | ≥98.0 (dried material, NT) |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 495.9±40.0 °C at 760 mmHg |
| Melting Point | 173-175 °C (lit.) |
| Appearance | powder |
| Storage Condition | Brown glass bottle with light-sealed packaging. St |
| Packaging | III |
| Application | Quinine is an antimalarial drug and potassium channel inhibitor with an IC50 value of 169 μM. |
| EINECS | 205-003-2 |
| HTC | 29392110 |
| PubChem ID | 57647993 |
| MDL Number | MFCD00198096 |
| SMILES | COc1ccc2nccc([C@@H](O)[C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1 |
| 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 |
| InChI Key | LOUPRKONTZGTKE-WZBLMQSHSA-N |
| Beilstein/REAXYS | 91867 |
| NACRES Code | NA.32 |
| UNSPSC | 12171500 |
| Hazard Symbols | 6.1(b) |
| MSDS | msds/20659_1_130_95_0.pdf |
| Bioactivity | Quinine is an anti-malaria agent and also a potassium channel inhibitor with an IC50 of 169 μM. Related Catalog Signaling Pathways >> Anti-infection >> Parasite Signaling Pathways >> Membrane Transporter/Ion Channel >> Potassium Channel Research Areas >> Infection Target IC50: 169 μM (potassium channel)[1] Parasite[2] References [1]. Wrighton DC, et al. Mechanism of inhibition of mouse Slo3 (KCa 5.1) potassium channels by quinine, quinidine and barium. Br J Pharmacol. 2015 Sep;172(17):4355-63. [2]. Hendriksen IC, et al. Population pharmacokinetic and pharmacodynamic properties of intramuscular quinine in Tanzanian children with severe Falciparum malaria. Antimicrob Agents Chemother. 2013 Feb;57(2):775-83. Chemical & Physical Properties Density 1.2±0.1 g/cm3 Boiling Point 495.9±40.0 °C at 760 mmHg Melting Point 176-177ºC Molecular Formula C20H24N2O2 Molecular Weight 324.417 Flash Point 253.7±27.3 °C Exact Mass 324.183777 PSA 45.59000 LogP 3.44 Vapour Pressure 0.0±1.3 mmHg at 25°C Index of Refraction 1.638 |
| Use of | Quinine is an anti-malaria agent and also a potassium channel inhibitor with an IC50 of 169 μM. Properties Articles197 Name quinine Synonym More Synonyms Quinine Biological Activity Description Quinine is an anti-malaria agent and also a potassium channel inhibitor with an IC50 of 169 μM. Related Catalog Signaling Pathways >> Anti-infection >> Parasite Signaling Pathways >> Membrane Transporter/Ion Channel >> Potassium Channel Research Areas >> Infection IC50: 169 μM (potassium channel)[1] Parasite[2] References [1]. Wrighton DC, et al. Mechanism of inhibition of mouse Slo3 (KCa 5.1) potassium channels by quinine, quinidine and barium. Br J Pharmacol. 2015 Sep;172(17):4355-63. [2]. Hendriksen IC, et al. Population pharmacokinetic and pharmacodynamic properties of intramuscular quinine in Tanzanian children with severe Falciparum malaria. Antimicrob Agents Chemother. 2013 Feb;57(2):775-83. Chemical & Physical Properties Molecular Formula C20H24N2O2 Exact Mass 324.183777 PSA 45.59000 Index of Refraction 1.638 |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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