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Substance Name: 1-Ethylpyrrolidin-3-yl cyclopentyl(hydroxy)phenylacetate hydrochloride
RN: 60573-74-2
UNII: Y04YSS47XS
InChIKey: WUZDQJPMWOHZRA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H27-N-O3.Cl-H

Molecular Weight

  • 353.887
 
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Names and Synonyms

Name of Substance

  • 1-Ethylpyrrolidin-3-yl cyclopentyl(hydroxy)phenylacetate hydrochloride

Synonyms

  • AHR 379
  • alpha-Cyclopentylmandelic acid 1-ethyl-3-pyrrolidinyl ester hydrochloride
  • Benzeneacetic acid, alpha-cyclopentyl-alpha-hydroxy-, 1-ethyl-3-pyrrolidinyl ester, HCl
  • UNII-Y04YSS47XS

Systematic Name

  • Mandelic acid, alpha-cyclopentyl-, 1-ethyl-3-pyrrolidinyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 60573-74-2

FDA UNII

  • Y04YSS47XS

System Generated Number

  • 0060573742

Molecular Formulas

Molecular Formula

  • C19-H27-N-O3.Cl-H

Molecular Formula Fragments

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

Structure Descriptors

InChI

1S/C19H27NO3.ClH/c1-2-20-13-12-17(14-20)23-18(21)19(22,16-10-6-7-11-16)15-8-4-3-5-9-15;/h3-5,8-9,16-17,22H,2,6-7,10-14H2,1H3;1H

InChIKey

WUZDQJPMWOHZRA-UHFFFAOYSA-N

Smiles

c1([C@@](C2CCCC2)(C(O[C@@H]2C[N@@H+](CC)CC2)=O)O)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 230mg/kg (230mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

SENSE ORGANS AND SPECIAL SENSES: MYDRIASIS (PUPILLARY DILATION): EYE

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 523, 1960.
mouse LD50 oral 480mg/kg (480mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

SENSE ORGANS AND SPECIAL SENSES: MYDRIASIS (PUPILLARY DILATION): EYE

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 523, 1960.