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Substance Name: 1-alpha-H,5-alpha-H-Tropan-3-beta-ol, (p-chlorophenyl)acetate (ester), hydrochloride
RN: 18650-52-7
InChIKey: XPMDKXYKAPDICY-NFWSUKNGSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H20-Cl-N-O2.Cl-H

Molecular Weight

  • 330.253
 
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Names and Synonyms

Synonym

  • psi-Tropine (p-chlorophenyl)acetate hydrochloride

Systematic Name

  • 1-alpha-H,5-alpha-H-Tropan-3-beta-ol, (p-chlorophenyl)acetate (ester), hydrochloride

Registry Numbers

CAS Registry Number

  • 18650-52-7

System Generated Number

  • 0018650527

Molecular Formulas

Molecular Formula

  • C16-H20-Cl-N-O2.Cl-H

Molecular Formula Fragments

  • C16-H20-Cl-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H20ClNO2.ClH/c1-18-13-6-7-14(18)10-15(9-13)20-16(19)8-11-2-4-12(17)5-3-11;/h2-5,13-15H,6-10H2,1H3;1H/t13-,14+,15-;

InChIKey

XPMDKXYKAPDICY-NFWSUKNGSA-N

Smiles

C(Cc1ccc(cc1)Cl)(=O)O[C@@H]1C[C@H]2CC[C@H](C1)N2C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo intravenous 14mg/kg (14mg/kg) PERIPHERAL NERVE AND SENSATION: FLACCID PARALYSIS WITHOUT ANESTHESIA (USUALLY NEUROMUSCULAR BLOCKAGE)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION

PERIPHERAL NERVE AND SENSATION: FASCICULATIONS
Toxicology and Applied Pharmacology. Vol. 5, Pg. 79, 1963.
mouse LD50 intravenous 10800ug/kg (10.8mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 175, 1968.