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Substance Name: Quinine bisulfate heptahydrate
RN: 6183-68-2
UNII: GNS01V2R3N
InChIKey: MMZACAMEMISONC-RYXXBYBMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H24-N2-O2.H2-O4-S.7H2-O

Molecular Weight

  • 548.603
 
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Names and Synonyms

Name of Substance

  • Quinine bisulfate heptahydrate

Synonyms

  • Quinine bisulfate heptahydrate
  • Quinine sulfate heptahydrate
  • UNII-GNS01V2R3N

Systematic Names

  • Cinchonan-9-ol, 6'-methoxy-, (8-alpha,9R)-, sulfate (1:1) (salt), heptahydrate (9CI)
  • Quinine, sulfate (1:1) (salt), heptahydrate

Registry Numbers

CAS Registry Number

  • 6183-68-2

FDA UNII

  • GNS01V2R3N

System Generated Number

  • 0006183682

Molecular Formulas

Molecular Formula

  • C20-H24-N2-O2.H2-O4-S.7H2-O

Molecular Formula Fragments

  • C20-H24-N2-O2
  • COMPONENT
  • H2-O
  • H2-O4-S

Structure Descriptors

InChI

1S/C20H24N2O2.H2O4S.7H2O/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;1-5(2,3)4;;;;;;;/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);7*1H2/t13-,14-,19-,20+;;;;;;;;/m0......../s1

InChIKey

MMZACAMEMISONC-RYXXBYBMSA-N

Smiles

O.O.O.O.O.O.O.COc1ccc2nccc([C@@H](O)[C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1.OS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 161mg/kg (161mg/kg)   Biochemical Journal. Vol. 28, Pg. 426, 1934.