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Substance Name: Coumarin, 8-((dimethylamino)methyl)-7-hydroxy-4-propyl-, nicotinate (salt)
RN: 10550-25-1
InChIKey: ZTOVXFBGXYIETH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H19-N-O3.C6-H5-N-O2

Molecular Weight

  • 384.43
 
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Names and Synonyms

Synonym

  • 8-((Dimethylamino)methyl)-7-hydroxy-4-propylcoumarin nicotinate (salt)

Systematic Name

  • Coumarin, 8-((dimethylamino)methyl)-7-hydroxy-4-propyl-, nicotinate (salt)

Registry Numbers

CAS Registry Number

  • 10550-25-1

System Generated Number

  • 0010550251

Molecular Formulas

Molecular Formula

  • C15-H19-N-O3.C6-H5-N-O2

Molecular Formula Fragments

  • C15-H19-N-O3
  • C6-H5-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C15H19NO3.C6H5NO2/c1-4-5-10-8-14(18)19-15-11(10)6-7-13(17)12(15)9-16(2)3;8-6(9)5-2-1-3-7-4-5/h6-8,17H,4-5,9H2,1-3H3;1-4H,(H,8,9)

InChIKey

ZTOVXFBGXYIETH-UHFFFAOYSA-N

Smiles

c12c(c(c(cc2)O)C[NH+](C)C)oc(=O)cc1CCC.c1(cccnc1)C(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 22mg/kg (22mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: EXCITEMENT

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Chimica Therapeutica. Vol. 1, Pg. 403, 1966.