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Substance Name: Dimecrotic acid magnesium salt
RN: 54283-65-7
UNII: 1IZ92DEM5B
InChIKey: NRMWCJKNPLZLMY-HIGYRTBYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H26-O8.Mg

Molecular Weight

  • 466.7664
 
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Names and Synonyms

Name of Substance

  • Dimecrotic acid magnesium salt

Synonyms

  • (Z)-3-(2,4-Dimethoxyphenyl)crotonic acid magnesium salt
  • 2-Butenoic acid, 3-(2,4-dimethoxyphenyl)-, magnesium salt, (Z)-
  • Dimecrotic acid magnesium salt
  • Hepadial
  • Magnesium salz der (2,4-dimethoxyphenyl)-3-crotonsaeure
  • Magnesium salz der (2,4-dimethoxyphenyl)-3-crotonsaeure [German]
  • UNII-1IZ92DEM5B

Systematic Name

  • Cinnamic acid, 2,4-dimethoxy-beta-methyl-, magnesium salt, (Z)-

Registry Numbers

CAS Registry Number

  • 54283-65-7

FDA UNII

  • 1IZ92DEM5B

System Generated Number

  • 0054283657

Molecular Formulas

Molecular Formula

  • C24-H26-O8.Mg

Molecular Formula Fragments

  • C24-H26-O8
  • COMPONENT
  • Mg

Structure Descriptors

InChI

1S/2C12H14O4.Mg/c2*1-8(6-12(13)14)10-5-4-9(15-2)7-11(10)16-3;/h2*4-7H,1-3H3,(H,13,14);/q;;+2/p-2/b2*8-6-;

InChIKey

NRMWCJKNPLZLMY-HIGYRTBYSA-L

Smiles

C/C(=C/C(=O)[O-])/c1c(cc(cc1)OC)OC.C/C(=C/C(=O)[O-])/c1c(cc(cc1)OC)OC.[Mg+2]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1300mg/kg (1300mg/kg)   German Patent Document. Vol. #1915023,
mouse LD50 oral 3gm/kg (3000mg/kg)   German Patent Document. Vol. #1915023,
rat LD50 intraperitoneal 1gm/kg (1000mg/kg)   German Patent Document. Vol. #1915023,
rat LD50 oral 3gm/kg (3000mg/kg)   German Patent Document. Vol. #1915023,