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Substance Name: Quinuronium sulfate
RN: 135-14-8
UNII: DE4G9V3O4A
InChIKey: BOMUADPKDXMXIH-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formulas

  • C21-H20-N4-O.2C-H3-O4-S
  • C23-H24-N4-O.2H-O4-S

Molecular Weight

  • 566.609
 
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Names and Synonyms

Name of Substance

  • Quinuronium sulfate

Synonyms

  • 1,3-Diquinolin-6-ylurea bismethosulfate
  • 6,6'-Ureylenebis(1,1'-dimethylquinolinium) sulfate
  • 6,6'-Ureylenebis(1-methylquinolinium)bis(methosulfate)
  • Acaprin
  • Atral
  • Baburan
  • Dimethylquinolyl methylsulfate urea
  • EINECS 205-179-0
  • Pirevan
  • Pyroplasmin
  • Quinuroium methylsulfate
  • Quinuronium sulfate
  • SN 5,870
  • UNII-DE4G9V3O4A
  • Urea, 1,3-diquinolin-6-yl-, bismethosulfate
  • Zothelone

Systematic Names

  • 1,1'-Dimethyl-6,6'-ureylenediquinolinium dimethyl bis(sulphate)
  • Quinolinium, 6,6'-(carbonyldiimino)bis(1-methyl-, bis(methyl sulfate)
  • Quinolinium, 6,6'-ureylenebis(1,1'-dimethyl-, sulfate (1:2)

Registry Numbers

CAS Registry Number

  • 135-14-8

FDA UNII

  • DE4G9V3O4A

System Generated Number

  • 0000135148

Molecular Formulas

Molecular Formulas

  • C21-H20-N4-O.2C-H3-O4-S
  • C23-H24-N4-O.2H-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C21-H20-N4-O
  • C23-H24-N4-O
  • COMPONENT
  • H-O4-S

Structure Descriptors

InChI

1S/C21H19N4O.2CH4O4S/c1-24-11-3-5-15-13-17(7-9-19(15)24)22-21(26)23-18-8-10-20-16(14-18)6-4-12-25(20)2;2*1-5-6(2,3)4/h3-14H,1-2H3,(H-,22,23,26);2*1H3,(H,2,3,4)/q+1;;/p-1

InChIKey

BOMUADPKDXMXIH-UHFFFAOYSA-M

Smiles

c12ccc(cc2ccc[n+]1C)NC(Nc1cc2c([n+](ccc2)C)cc1)=O.COS([O-])(=O)=O.COS([O-])(=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 4800ug/kg (4.8mg/kg)   Toxicology Letters. Vol. 20, Pg. 69, 1984.
mouse LD50 subcutaneous 5400ug/kg (5.4mg/kg)   Toxicology Letters. Vol. 20, Pg. 69, 1984.
rat LD50 intraperitoneal 6300ug/kg (6.3mg/kg)   Toxicology Letters. Vol. 20, Pg. 69, 1984.
rat LD50 subcutaneous 6500ug/kg (6.5mg/kg)   Toxicology Letters. Vol. 20, Pg. 69, 1984.