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Substance Name: Deschlorobenzoylacemetacin
RN: 75511-23-8
InChIKey: DQBOZICMPBWODK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H15-N-O5

Molecular Weight

  • 277.2745
 
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Names and Synonyms

Results Name

  • Deschlorobenzoylacemetacin

Synonyms

  • Carboxymethyl 5-methoxy-2-methyl-1H-indole-3-acetate
  • Deschlorobenzoylacemetacin

Systematic Name

  • 1H-Indole-3-acetic acid, 5-methoxy-2-methyl-, carboxymethyl ester

Registry Numbers

CAS Registry Number

  • 75511-23-8

System Generated Number

  • 0075511238

Structure Descriptors

InChI

1S/C14H15NO5/c1-8-10(6-14(18)20-7-13(16)17)11-5-9(19-2)3-4-12(11)15-8/h3-5,15H,6-7H2,1-2H3,(H,16,17)

InChIKey

DQBOZICMPBWODK-UHFFFAOYSA-N

Smiles

Cc1c(c2cc(ccc2[nH]1)OC)CC(=O)OCC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 4gm/kg (4000mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 22, Pg. 657, 1981.