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Substance Name: Pyrrolidine, 1-(2-(4-(3,4-dihydro-7-methoxy-2,2-dimethyl-3-phenyl-2H-1-benzopyran-4-yl)phenoxy)ethyl)-, hydrochloride, trans-(-)-
RN: 79386-05-3
InChIKey: ZRGUGBSQWQXLHB-XZVFQGBBSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H35-N-O3.Cl-H

Molecular Weight

  • 494.0714
 
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Names and Synonyms

  • Pyrrolidine, 1-(2-(4-(3,4-dihydro-7-methoxy-2,2-dimethyl-3-phenyl-2H-1-benzopyran-4-yl)phenoxy)ethyl)-, hydrochloride, trans-(-)-

Registry Numbers

CAS Registry Number

  • 79386-05-3

System Generated Number

  • 0079386053

Molecular Formulas

Molecular Formula

  • C30-H35-N-O3.Cl-H

Molecular Formula Fragments

  • C30-H35-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C30H35NO3.ClH/c1-30(2)29(23-9-5-4-6-10-23)28(26-16-15-25(32-3)21-27(26)34-30)22-11-13-24(14-12-22)33-20-19-31-17-7-8-18-31;/h4-6,9-16,21,28-29H,7-8,17-20H2,1-3H3;1H/t28-,29+;/m1./s1

InChIKey

ZRGUGBSQWQXLHB-XZVFQGBBSA-N

Smiles

CC1([C@H]([C@@H](c2ccc(cc2O1)OC)c3ccc(cc3)OCCN4CCCC4)c5ccccc5)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 500mg/kg (500mg/kg)   Indian Journal of Pharmaceutical Sciences. Vol. 49, Pg. 43, 1987.