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Substance Name: (-)-2-beta-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate, hydrochloride
RN: 64471-29-0
InChIKey: NCKWTTJHMFCTPI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H29-N-O3.Cl-H

Molecular Weight

  • 379.925
 
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Names and Synonyms

  • (-)-2-beta-Tropan-2-ol, (+-)-2-cyclopentyl-2-phenylglycolate, hydrochloride

Registry Numbers

CAS Registry Number

  • 64471-29-0

System Generated Number

  • 0064471290

Molecular Formulas

Molecular Formula

  • C21-H29-N-O3.Cl-H

Molecular Formula Fragments

  • C21-H29-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H29NO3.ClH/c1-22-17-11-13-18(22)19(14-12-17)25-20(23)21(24,16-9-5-6-10-16)15-7-3-2-4-8-15;/h2-4,7-8,16-19,24H,5-6,9-14H2,1H3;1H

InChIKey

NCKWTTJHMFCTPI-UHFFFAOYSA-N

Smiles

CN1C2CCC1C(CC2)OC(=O)C(c3ccccc3)(C4CCCC4)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 71mg/kg (71mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1612, 1977.