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General Information

This Model was autogenerated from the "Quick Submit" tool.

Model ID

3DPX-017055

Category

Small Molecules

Keyword(s)

Quinine, 130-95-0, Chinine, (-)-Quinine, Chinin, 6'-Methoxycinchonidine, (8S,9R)-Quinine, quinine sulfate, Quinine anhydrous, (R)-(-)-quinine

PubChem CID

3034034

Quinine is a cinchona alkaloid that is cinchonidine in which the hydrogen at the 6-position of the quinoline ring is substituted by methoxy. It has a role as an antimalarial, a muscle relaxant and a non-narcotic analgesic. It is a conjugate base of a quinine(1+). It derives from a hydride of an (8S)-cinchonan.

Molecular Weight

g/mol

Molecular Formula

COC₁=CC₂=C(C=CN=C₂C=C₁)[C@H]([C@@H]₃C[C@@H]₄CCN₃C[C@@H]₄C=C)O

IUPAC

(R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol

CAS

72402-53-0

Documentation

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