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Substance Name: Elgodipine hydrochloride
RN: 121489-04-1
UNII: MIR106H7SI
InChIKey: JBKDMKOYLBVOOR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H33-F-N2-O6.Cl-H

Molecular Weight

  • 561.0466
 
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Names and Synonyms

Name of Substance

  • Elgodipine hydrochloride

Synonyms

  • Elgodipine HCl
  • Elgodipine hydrochloride
  • IQB-875
  • UNII-MIR106H7SI

Systematic Name

  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(1,3-benzodioxol-4-yl)-2,6-dimethyl-, 2-(((4-fluorophenyl)methyl)methylamino)ethyl 1-methylethyl ester, (+-)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 121489-04-1

FDA UNII

  • MIR106H7SI

System Generated Number

  • 0121489041

Molecular Formulas

Molecular Formula

  • C29-H33-F-N2-O6.Cl-H

Molecular Formula Fragments

  • C29-H33-F-N2-O6
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C29H33FN2O6.ClH/c1-17(2)38-29(34)25-19(4)31-18(3)24(26(25)22-7-6-8-23-27(22)37-16-36-23)28(33)35-14-13-32(5)15-20-9-11-21(30)12-10-20;/h6-12,17,26,31H,13-16H2,1-5H3;1H

InChIKey

JBKDMKOYLBVOOR-UHFFFAOYSA-N

Smiles

CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)c2cccc3c2OCO3)C(=O)OCCN(C)Cc4ccc(cc4)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 31200ug/kg (31.2mg/kg)   Drugs of the Future. Vol. 20, Pg. 231, 1995.
mouse LD50 intravenous 1800ug/kg (1.8mg/kg)   Drugs of the Future. Vol. 20, Pg. 231, 1995.
mouse LD50 oral 62800ug/kg (62.8mg/kg)   Drugs of the Future. Vol. 20, Pg. 231, 1995.
rat LD50 intraperitoneal 48600ug/kg (48.6mg/kg)   Drugs of the Future. Vol. 20, Pg. 231, 1995.
rat LD50 intravenous 3900ug/kg (3.9mg/kg)   Drugs of the Future. Vol. 20, Pg. 231, 1995.
rat LD50 oral 64mg/kg (64mg/kg)   Drugs of the Future. Vol. 20, Pg. 231, 1995.