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Substance Name: (+)-2-beta-Tropan-2-ol, (+)-2-cyclopentyl-2-(2-thienyl)glycolate, hydrochloride
RN: 64471-33-6
InChIKey: IJLBTCXBESFTGK-HVDHJMMNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H27-N-O3-S.Cl-H

Molecular Weight

  • 385.9532
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 64471-33-6

System Generated Number

  • 0064471336

Molecular Formulas

Molecular Formula

  • C19-H27-N-O3-S.Cl-H

Molecular Formula Fragments

  • C19-H27-N-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H27NO3S.ClH/c1-20-14-8-10-15(20)16(11-9-14)23-18(21)19(22,13-5-2-3-6-13)17-7-4-12-24-17;/h4,7,12-16,22H,2-3,5-6,8-11H2,1H3;1H/t14-,15-,16+,19+;/m0./s1

InChIKey

IJLBTCXBESFTGK-HVDHJMMNSA-N

Smiles

CN1[C@H]2CC[C@H]1[C@@H](CC2)OC(=O)[C@](c3cccs3)(C4CCCC4)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 36mg/kg (36mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1612, 1977.