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Substance Name: Cyclohexaneglycolic acid, alpha-phenyl-, 3-quinuclidinyl ester
RN: 29125-54-0
InChIKey: SWZDDEVSNRTITP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H29-N-O3

Molecular Weight

  • 343.464
 
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Names and Synonyms

Synonyms

  • 3-((2-Cyclohexyl-2-hydroxy-2-phenylethanoyl)oxy)quinuclidine
  • 3-Quinuclidinyl alpha-phenylcyclohexaneglycolate

Systematic Name

  • Cyclohexaneglycolic acid, alpha-phenyl-, 3-quinuclidinyl ester

Registry Numbers

CAS Registry Number

  • 29125-54-0

System Generated Number

  • 0029125540

Structure Descriptors

InChI

1S/C21H29NO3/c23-20(25-19-15-22-13-11-16(19)12-14-22)21(24,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1,3-4,7-8,16,18-19,24H,2,5-6,9-15H2

InChIKey

SWZDDEVSNRTITP-UHFFFAOYSA-N

Smiles

c1(ccccc1)[C@@](C(=O)O[C@@H]1CN2CCC1CC2)(O)C1CCCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 67mg/kg (67mg/kg)   United States Patent Document. Vol. #3714357,
mouse LDLo subcutaneous 620mg/kg (620mg/kg)   United States Patent Document. Vol. #3714357,
rat LDLo subcutaneous > 940mg/kg (940mg/kg)   United States Patent Document. Vol. #3714357,