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Substance Name: Ecabet sodium [JAN]
RN: 86408-72-2
UNII: 51MO2B2OSB
InChIKey: RCVIHORGZULVTN-YGJXXQMASA-M

Classification Codes

  • Anti-Infective Agents
  • Gastrointestinal Agents
  • Reproductive Effect

Molecular Formula

  • C20-H28-O5-S.Na

Molecular Weight

  • 402.4843
 
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Names and Synonyms

Name of Substance

  • Ecabet sodium salt
  • Ecabet sodium [JAN]

Synonyms

  • 12-Sulfodehydroabietic acid monosodium salt
  • Ecabet sodium
  • Sulfodehydroabietic acid monosodium salt
  • TA-2711
  • UNII-51MO2B2OSB

Systematic Name

  • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-6-sulfo-, (1R-(1-alpha,4a-beta,10a-alpha))-, monosodium salt

Registry Numbers

CAS Registry Number

  • 86408-72-2

FDA UNII

  • 51MO2B2OSB

System Generated Number

  • 0086408722

Molecular Formulas

Molecular Formula

  • C20-H28-O5-S.Na

Molecular Formula Fragments

  • C20-H28-O5-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C20H28O5S.Na/c1-12(2)14-10-13-6-7-17-19(3,8-5-9-20(17,4)18(21)22)15(13)11-16(14)26(23,24)25;/h10-12,17H,5-9H2,1-4H3,(H,21,22)(H,23,24,25);/q;+1/p-1/t17-,19-,20-;/m1./s1

InChIKey

RCVIHORGZULVTN-YGJXXQMASA-M

Smiles

CC(C)c1cc2c(cc1S(=O)(=O)[O-])[C@]3(CCC[C@@]([C@@H]3CC2)(C)C(=O)O)C.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 oral > 2gm/kg (2000mg/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 36, Pg. 667, 1994.
rat LD50 oral > 2gm/kg (2000mg/kg)   United States Patent Document. Vol. #4529602,
rat LD50 subcutaneous > 2gm/kg (2000mg/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 36, Pg. 667, 1994.