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Substance Name: Delmetacin [INN]
RN: 16401-80-2
UNII: I9Q51XHI1K
InChIKey: AZCOEIZFVQEQCU-UHFFFAOYSA-N

Note

  • Anti-inflammatory agent related to indomethacin.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H15-N-O3

Molecular Weight

  • 293.3205
 
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Names and Synonyms

Name of Substance

  • Delmetacin
  • Delmetacin [INN]

Synonyms

  • 1-Benzoyl-2-methyl-3-indolylessigsaeure
  • 1-Benzoyl-2-methylindole-3-acetic acid
  • 5-22-03-00124 (Beilstein Handbook Reference)
  • BRN 0488508
  • Delmetacin
  • Delmetacina
  • Delmetacina [INN-Spanish]
  • Delmetacina [Spanish]
  • Delmetacine
  • Delmetacine [INN-French]
  • Delmetacinum
  • Delmetacinum [INN-Latin]
  • UNII-I9Q51XHI1K
  • UR 2310
  • UR-2310

Systematic Names

  • 1-Benzoyl-2-methylindole-3-acetic acid
  • 1H-Indole-3-acetic acid, 1-benzoyl-2-methyl- (9CI)
  • Indole-3-acetic acid, 1-benzoyl-2-methyl-

Registry Numbers

CAS Registry Number

  • 16401-80-2

FDA UNII

  • I9Q51XHI1K

System Generated Number

  • 0016401802

Structure Descriptors

InChI

1S/C18H15NO3/c1-12-15(11-17(20)21)14-9-5-6-10-16(14)19(12)18(22)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,20,21)

InChIKey

AZCOEIZFVQEQCU-UHFFFAOYSA-N

Smiles

Cc1c(c2ccccc2n1C(=O)c3ccccc3)CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 609mg/kg (609mg/kg)   Archivos de Farmacologia y Toxicologia. Vol. 8, Pg. 201, 1982.
mouse LD50 intravenous > 40mg/kg (40mg/kg)   Archivos de Farmacologia y Toxicologia. Vol. 8, Pg. 201, 1982.
mouse LD50 oral 820mg/kg (820mg/kg)   Archivos de Farmacologia y Toxicologia. Vol. 8, Pg. 201, 1982.
rat LD50 intraperitoneal 262mg/kg (262mg/kg)   Archivos de Farmacologia y Toxicologia. Vol. 8, Pg. 201, 1982.
rat LD50 oral 362mg/kg (362mg/kg)   Archivos de Farmacologia y Toxicologia. Vol. 8, Pg. 201, 1982.