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Substance Name: (+)-2-alpha-Tropan-2-ol, (+)-2-phenyl-2-(2-thienyl)glycolate
RN: 64471-16-5
InChIKey: XGVQNYKSWMAKQT-PFRQMTDMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H23-N-O3-S

Molecular Weight

  • 357.4717
 
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Names and Synonyms

Synonym

  • BRN 1504993

Systematic Name

  • (+)-2-alpha-Tropan-2-ol, (+)-2-phenyl-2-(2-thienyl)glycolate

Registry Numbers

CAS Registry Number

  • 64471-16-5

System Generated Number

  • 0064471165

Structure Descriptors

InChI

1S/C20H23NO3S/c1-21-15-9-11-16(21)17(12-10-15)24-19(22)20(23,18-8-5-13-25-18)14-6-3-2-4-7-14/h2-8,13,15-17,23H,9-12H2,1H3/t15-,16+,17-,20+/m0/s1

InChIKey

XGVQNYKSWMAKQT-PFRQMTDMSA-N

Smiles

CN1[C@H]2CC[C@@H]1[C@H](CC2)OC(=O)[C@@](c3ccccc3)(c4cccs4)O

Toxicity

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