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Substance Name: Centhchroman hydrochloride
RN: 51023-56-4
UNII: GL3LAI70F3
InChIKey: ZRGUGBSQWQXLHB-XZVFQGBBSA-N

Note

  • A non-steroidal anti-fertility agent with anti-hormonal properties.

Classification Codes

  • Drug / Therapeutic Agent
  • Reproductive Effect

Molecular Formula

  • C30-H35-N-O3.Cl-H

Molecular Weight

  • 494.0714
 
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Names and Synonyms

Name of Substance

  • Centhchroman hydrochloride

Synonyms

  • 3,4-trans-2,2-Dimethyl-3-phenyl-4-p-(beta-pyrrolidinoethoxy)phenyl-7-methoxychroman HCl
  • 67/20CDRI
  • Centchroman hydrochloride
  • Centhchroman HCl
  • UNII-GL3LAI70F3

Systematic Name

  • Chroman, 3,4-trans-2,2-dimethyl-3-phenyl-4-p-(beta-pyrrolidinoethoxy)phenyl-7-methoxy-, hydrochloride

Registry Numbers

CAS Registry Number

  • 51023-56-4

FDA UNII

  • GL3LAI70F3

System Generated Number

  • 0051023564

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 intraperitoneal 400mg/kg (400mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION
Indian Journal of Experimental Biology. Vol. 15, Pg. 1159, 1977.
mouse LDLo oral 1600mg/kg (1600mg/kg)   Indian Journal of Experimental Biology. Vol. 15, Pg. 1159, 1977.
rat LDLo oral 1600mg/kg (1600mg/kg)   Indian Journal of Experimental Biology. Vol. 15, Pg. 1159, 1977.