Antimalarial ligands

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  1. Quinine
    Cas#: 130-95-0        Compound CID:  3034034
    Formula:  C20H24N2O2        Molecular Weight: 324.42
    IUPAC Name: (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
    SMILES: COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O
    InChIKey: LOUPRKONTZGTKE-WZBLMQSHSA-N
    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
    Synonyms: (9R)-6'-methoxy-8alpha-cinchonan-9-ol | Quinoline alkaloid | Quinsan | (R)-[(1S,2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2....
  2. Quinine, Agonist of TAS2R14;Agonist of TAS2R40;Channel blocker of K 2P18.1;Channel blocker of K v2.2;Inhibitor of Plasma membrane monoamine transporter
    Cas#: 130-95-0        Compound CID:  3034034
    Formula:  C20H24N2O2        Molecular Weight: 324.42
    IUPAC Name: (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
    SMILES: COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O
    InChIKey: LOUPRKONTZGTKE-WZBLMQSHSA-N
    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
    Synonyms: (9R)-6'-methoxy-8alpha-cinchonan-9-ol | Quinoline alkaloid | Quinsan | (R)-[(1S,2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2....
  3. ML324, Inhibitor of lysine demethylase 4A;Inhibitor of lysine demethylase 4E
    Cas#: 1222800-79-4        Compound CID:  44143209
    Formula:  C21H23N3O2        Molecular Weight: 349.43
    IUPAC Name: N-[3-(dimethylamino)propyl]-4-(8-hydroxyquinolin-6-yl)benzamide
    SMILES: CN(C)CCCNC(=O)C1=CC=C(C=C1)C2=CC(=C3C(=C2)C=CC=N3)O
    InChIKey: QDBVSOZTVKXUES-UHFFFAOYSA-N
    InChI: InChI=1S/C21H23N3O2/c1-24(2)12-4-11-23-21(26)16-8-6-15(7-9-16)18-13-17-5-3-10-22-20(17)19(25)14-18/h3,5-10,13-14,25H,4,11-12H2,1-2H3,(H,23,26)
    Synonyms: NCGC00183808-17 | MMV1580488 | N-[3-(dimethylamino)propyl]-4-(8-oxidanylquinolin-6-yl)benzamide;2,2,2-tris(fluoranyl)...
  4. ML324, Inhibitor of lysine demethylase 4A;Inhibitor of lysine demethylase 4E
    Cas#: 1222800-79-4        Compound CID:  44143209
    Formula:  C21H23N3O2        Molecular Weight: 349.43
    IUPAC Name: N-[3-(dimethylamino)propyl]-4-(8-hydroxyquinolin-6-yl)benzamide
    SMILES: CN(C)CCCNC(=O)C1=CC=C(C=C1)C2=CC(=C3C(=C2)C=CC=N3)O
    InChIKey: QDBVSOZTVKXUES-UHFFFAOYSA-N
    InChI: InChI=1S/C21H23N3O2/c1-24(2)12-4-11-23-21(26)16-8-6-15(7-9-16)18-13-17-5-3-10-22-20(17)19(25)14-18/h3,5-10,13-14,25H,4,11-12H2,1-2H3,(H,23,26)
    Synonyms: ML324|1222800-79-4|ML-324|N-(3-(Dimethylamino)propyl)-4-(8-hydroxyquinolin-6-yl)benzamide|N-[3-(dimethylamino)propyl]...
  5. Quinine, Agonist of TAS2R14;Agonist of TAS2R40;Channel blocker of K 2P18.1;Channel blocker of K v2.2;Inhibitor of Plasma membrane monoamine transporter
    Cas#: 130-95-0        Compound CID:  3034034
    Formula:  C20H24N2O2        Molecular Weight: 324.42
    IUPAC Name: (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
    SMILES: COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O
    InChIKey: LOUPRKONTZGTKE-WZBLMQSHSA-N
    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
    Synonyms: Quinine|130-95-0|Chinin|Chinine|(-)-Quinine|6'-Methoxycinchonidine|(8S,9R)-Quinine|Qualaquin|Quinine anhydrous|(R)-(-...
  6. (-)-Quinine
      Grade & Purity: 
    • Moligand™
    • for resolution of racemates for synthesis
    Cas#: 130-95-0        Compound CID:  3034034
    Formula:  C20H24N2O2        Molecular Weight: 324.42
    IUPAC Name: (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
    SMILES: COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O
    InChIKey: LOUPRKONTZGTKE-WZBLMQSHSA-N
    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
    Synonyms: (9R)-6'-methoxy-8alpha-cinchonan-9-ol | Quinoline alkaloid | Quinsan | (R)-[(1S,2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2....
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