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Substance Name: Pyridinium, 1,2,3,6-tetrahydro-1-alpha-carboxybenzyl-1-methyl-, iodide, ester with diethyl (2-(2-hydroxyethoxy)ethyl)methylammonium iodide
RN: 102206-85-9
InChIKey: BDYUMUXYUZJFTP-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H38-N2-O3.2I

Molecular Weight

  • 644.3642
 
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Names and Synonyms

  • Pyridinium, 1,2,3,6-tetrahydro-1-alpha-carboxybenzyl-1-methyl-, iodide, ester with diethyl (2-(2-hydroxyethoxy)ethyl)methylammonium iodide

Registry Numbers

CAS Registry Number

  • 102206-85-9

System Generated Number

  • 0102206859

Molecular Formulas

Molecular Formula

  • C23-H38-N2-O3.2I

Molecular Formula Fragments

  • C23-H38-N2-O3
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C23H38N2O3.2HI/c1-5-24(3,6-2)17-18-27-19-20-28-23(26)22(21-13-9-7-10-14-21)25(4)15-11-8-12-16-25;;/h7-11,13-14,22H,5-6,12,15-20H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

BDYUMUXYUZJFTP-UHFFFAOYSA-L

Smiles

CC[N+](C)(CC)CCOCCOC(=O)C(c1ccccc1)[N+]2(CCC=CC2)C.[I-].[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 3450ug/kg (3.45mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

PERIPHERAL NERVE AND SENSATION: FLACCID PARALYSIS WITHOUT ANESTHESIA (USUALLY NEUROMUSCULAR BLOCKAGE)
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 125, Pg. 121, 1960.