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Substance Name: 4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, sodium salt
RN: 58348-97-3
InChIKey: VLLATRQRPYHZLR-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H11-O4.Na

Molecular Weight

  • 302.2599
 
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Names and Synonyms

Synonyms

  • 3-Methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxylic acid sodium salt
  • 3-Methylflavone-8-carboxylic acid sodium salt

Systematic Name

  • 4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, sodium salt

Registry Numbers

CAS Registry Number

  • 58348-97-3

System Generated Number

  • 0058348973

Molecular Formulas

Molecular Formula

  • C17-H11-O4.Na

Molecular Formula Fragments

  • C17-H11-O4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C17H12O4.Na/c1-10-14(18)12-8-5-9-13(17(19)20)16(12)21-15(10)11-6-3-2-4-7-11;/h2-9H,1H3,(H,19,20);/q;+1/p-1

InChIKey

VLLATRQRPYHZLR-UHFFFAOYSA-M

Smiles

[Na+].CC1=C(Oc2c(cccc2C1=O)C(=O)[O-])c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 336mg/kg (336mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 25, Pg. 1916, 1975.
rat LD50 oral 1655mg/kg (1655mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 25, Pg. 1916, 1975.