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Substance Name: Theophylline, 8-ethyl-, 7-oxide
RN: 14305-94-3
InChIKey: ACLKMYYXRGUYOY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H12-N4-O3

Molecular Weight

  • 224.2188
 
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Names and Synonyms

Synonyms

  • 1,3-Dimethyl-8-ethylxanthine 7-oxide
  • 5-26-14-00180 (Beilstein Handbook Reference)
  • 8-Aethyl-8H-theophyllin-7-N-oxid
  • 8-Aethyl-8H-theophyllin-7-N-oxid [German]
  • 8-Ethyltheophylline 7-oxide
  • BRN 0542433
  • GD 405

Systematic Name

  • Theophylline, 8-ethyl-, 7-oxide

Registry Numbers

CAS Registry Number

  • 14305-94-3

System Generated Number

  • 0014305943

Structure Descriptors

InChI

1S/C9H12N4O3/c1-4-5-10-7-6(13(5)16)8(14)12(3)9(15)11(7)2/h7H,4H2,1-3H3

InChIKey

ACLKMYYXRGUYOY-UHFFFAOYSA-N

Smiles

CCC1=NC2C(=N1=O)C(=O)N(C(=O)N2C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 103mg/kg (103mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Acta Biologica et Medica Germanica. Vol. 21, Pg. 501, 1968.