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Substance Name: Ditran
RN: 8015-54-1
InChIKey: BHAQKBQTNVWCPO-UHFFFAOYSA-N

Note

  • Contains 70% 1-ethyl-2-pyrrolidinylmethyl-alpha-phenylcyclopentylglycolate & 30% 1-ethyl-3-piperidyl-alpha-phenylcyclopentylglycolate.

Classification Code

  • Human Data

Molecular Formula

  • C20-H29-N-O3.C20-H29-N-O3.2Cl-H

Molecular Weight

  • 735.828
 
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Names and Synonyms

Name of Substance

  • Ditran

Synonyms

  • 1-Ethyl-3-piperidyl alpha-cyclopentyl-alpha-phenylglycolate hydrochloride
  • CS 4298
  • CS 62025
  • Ditran
  • JB 329

Systematic Name

  • Mandelic acid, alpha-cyclopentyl-, 1-ethyl-3-piperidyl ester, hydrochloride, mixed with (1-ethyl-2-pyrrolidinyl)methyl alpha-cyclopentylmandelate hydrochloride

Registry Numbers

CAS Registry Number

  • 8015-54-1

System Generated Number

  • 0008015541

Molecular Formulas

Molecular Formula

  • C20-H29-N-O3.C20-H29-N-O3.2Cl-H

Molecular Formula Fragments

  • C20-H29-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/2C20H29NO3.2ClH/c2*1-2-21-14-8-13-18(21)15-24-19(22)20(23,17-11-6-7-12-17)16-9-4-3-5-10-16;;/h2*3-5,9-10,17-18,23H,2,6-8,11-15H2,1H3;2*1H

InChIKey

BHAQKBQTNVWCPO-UHFFFAOYSA-N

Smiles

C1[C@@H](COC([C@@](C2CCCC2)(O)c2ccccc2)=O)[N@@](CC1)CC.Cl.Cl.C1[C@@H]([N@@](CC1)CC)COC([C@@](c1ccccc1)(C1CCCC1)O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 intravenous 45mg/kg (45mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 224, 1972.
human TDLo intramuscular 100ug/kg (0.1mg/kg) BEHAVIORAL: "HALLUCINATIONS, DISTORTED PERCEPTIONS"

SENSE ORGANS AND SPECIAL SENSES: MYDRIASIS (PUPILLARY DILATION): EYE
"Possible Long-Term Health Effects of Short-Term Exposure to Chemical Agents," National Research Council, 3 vols., Washington, DC, National Academy Press, 1982-85Vol. 1, Pg. L1, 1982.
human TDLo oral 40ug/kg (0.04mg/kg) GASTROINTESTINAL: NAUSEA OR VOMITING

SENSE ORGANS AND SPECIAL SENSES: VISUAL FIELD CHANGES: EYE

BEHAVIORAL: "HALLUCINATIONS, DISTORTED PERCEPTIONS"
Journal of Nervous and Mental Disease. Vol. 131, Pg. 428, 1960.
man TDLo intramuscular 150ug/kg (0.15mg/kg) BEHAVIORAL: "HALLUCINATIONS, DISTORTED PERCEPTIONS" Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 32, Pg. 250, 1973.
mouse LD50 intraperitoneal 60mg/kg (60mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 224, 1972.
mouse LD50 intravenous 10mg/kg (10mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 224, 1972.
mouse LD50 oral 300mg/kg (300mg/kg) BEHAVIORAL: EXCITEMENT

BEHAVIORAL: IRRITABILITY

SENSE ORGANS AND SPECIAL SENSES: OTHER: EYE
Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 1727, 1971.
rabbit LD50 intravenous 12mg/kg (12mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 224, 1972.
rat LD50 intraperitoneal 25mg/kg (25mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 224, 1972.
rat LD50 intravenous 19mg/kg (19mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 224, 1972.