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Substance Name: Mandelic acid, alpha-(2-thienyl)-, 1-methyl-3-piperidyl ester
RN: 63917-18-0
InChIKey: MZZQSAPGRDBPFR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H21-N-O3-S

Molecular Weight

  • 331.434
 
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Names and Synonyms

Synonyms

  • 1-Methyl-3-piperidyl-alpha-(2-thienyl)mandelate
  • BRN 1397393

Systematic Name

  • Mandelic acid, alpha-(2-thienyl)-, 1-methyl-3-piperidyl ester

Registry Numbers

CAS Registry Number

  • 63917-18-0

System Generated Number

  • 0063917180

Structure Descriptors

InChI

1S/C18H21NO3S/c1-19-11-5-9-15(13-19)22-17(20)18(21,16-10-6-12-23-16)14-7-3-2-4-8-14/h2-4,6-8,10,12,15,21H,5,9,11,13H2,1H3

InChIKey

MZZQSAPGRDBPFR-UHFFFAOYSA-N

Smiles

c1([C@@](c2ccccc2)(C(O[C@@H]2C[N@@](CCC2)C)=O)O)cccs1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 47mg/kg (47mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: MUSCLE WEAKNESS

CARDIAC: PULSE RATE INCREASE WITHOUT FALL IN BP
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 120, Pg. 186, 1959.
rat LD50 intravenous 20mg/kg (20mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: MUSCLE WEAKNESS

CARDIAC: PULSE RATE INCREASE WITHOUT FALL IN BP
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 120, Pg. 186, 1959.