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Substance Name: Theophylline, 7-(3-(aminooxy)propyl)-, monohydrochloride
RN: 59663-17-1
InChIKey: BVRLERJMXAEBAA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H15-N5-O3.Cl-H

Molecular Weight

  • 289.7214
 
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Names and Synonyms

Synonyms

  • 1H-Purine-2,6-dione, 3,7-dihydro-7-(3-(aminooxy)propyl)-1,3-dimethyl-, hydrochloride
  • 7-gamma-Aminooxypropyltheophylline hydrochloride

Systematic Name

  • Theophylline, 7-(3-(aminooxy)propyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 59663-17-1

System Generated Number

  • 0059663171

Molecular Formulas

Molecular Formula

  • C10-H15-N5-O3.Cl-H

Molecular Formula Fragments

  • C10-H15-N5-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C10H15N5O3.ClH/c1-13-8-7(9(16)14(2)10(13)17)15(6-12-8)4-3-5-18-11;/h6H,3-5,11H2,1-2H3;1H

InChIKey

BVRLERJMXAEBAA-UHFFFAOYSA-N

Smiles

Cl.CN1C(=O)N(C)c2ncn(CCCON)c2C1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 750mg/kg (750mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Acta Pharmaceutica Jugoslavica. Vol. 26, Pg. 125, 1976.