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Substance Name: Benproperine phosphate [JAN]
RN: 3563-76-6
InChIKey: MCVUURBOSHQXMK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N-O.x-H3-O4-P

Molecular Weight

  • 407.444
 
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Names and Synonyms

Name of Substance

  • Benproperine phosphate [JAN]
  • Benproperine trihydrogen phosphate

Synonyms

  • 1-(1-Methyl-2-((alpha-phenyl-o-tolyl)oxy)ethyl)piperidine phosphate
  • 1-(2-(2-Benzilfenossi)-1-metiletil)-piperidina fosfato
  • 1-(2-(2-Benzilfenossi)-1-metiletil)-piperidina fosfato [Italian]
  • 1-(2-Benzylphenoxy)-2-piperidinopropane phosphate
  • ASA 158-5
  • Benproperine phosphate
  • Blascorid
  • EINECS 243-050-0
  • Pirexyl phosphate

Systematic Names

  • 1-(2-(2-Benzylphenoxy)-1-methylethyl)piperidinium dihydrogen phosphate
  • Benproperine phosphate
  • Piperidine, 1-(1-methyl-2-((alpha-phenyl-o-tolyl)oxy)ethyl)-, phosphate
  • Piperidine, 1-(1-methyl-2-(2-(phenylmethyl)phenoxy)ethyl)-, phosphate (9CI)

Registry Numbers

CAS Registry Number

  • 3563-76-6

System Generated Number

  • 0003563766

Molecular Formulas

Molecular Formula

  • C21-H27-N-O.x-H3-O4-P

Molecular Formula Fragments

  • C21-H27-N-O
  • COMPONENT
  • H3-O4-P

Structure Descriptors

InChI

1S/C21H27NO.H3O4P/c1-18(22-14-8-3-9-15-22)17-23-21-13-7-6-12-20(21)16-19-10-4-2-5-11-19;1-5(2,3)4/h2,4-7,10-13,18H,3,8-9,14-17H2,1H3;(H3,1,2,3,4)

InChIKey

MCVUURBOSHQXMK-UHFFFAOYSA-N

Smiles

N1([C@@H](COc2c(cccc2)Cc2ccccc2)C)CCCCC1.P(=O)(O)(O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 128mg/kg (128mg/kg)   Yaoxue Tongbao. Bulletin of Pharmacology. Vol. 22, Pg. 568, 1987.
mouse LD50 intravenous 32mg/kg (32mg/kg)   Drugs in Japan Vol. 6, Pg. 782, 1982.
mouse LD50 oral 1100mg/kg (1100mg/kg)   Drugs in Japan Vol. 6, Pg. 782, 1982.
mouse LD50 subcutaneous 710mg/kg (710mg/kg)   Drugs in Japan Vol. 6, Pg. 782, 1982.