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Substance Name: Strychnine N6-oxide
RN: 7248-28-4
UNII: 774C760V46
InChIKey: ADTDBAKUQAKBGZ-VXJIXCKJSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H22-N2-O3

Molecular Weight

  • 350.416
 
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Names and Synonyms

Name of Substance

  • Strychnine N-oxide
  • Strychnine N6-oxide

Synonyms

  • 2-27-00-00739 (Beilstein Handbook Reference)
  • BRN 0102320
  • EINECS 230-656-5
  • Genostrychnine
  • N-Oxystrychnine
  • NSC 127569
  • NSC 24951
  • Strychnin-N6-oxide
  • Strychnine N6-oxide
  • Strychnine, N(sup 6)-oxide
  • Strychnine, N-oxide
  • Strychnine, N6-oxide
  • Strychnine-N-oxide
  • UNII-774C760V46

Systematic Names

  • Strychnidin-10-one, 19-oxide
  • Strychnine, 19-oxide

Registry Numbers

CAS Registry Number

  • 7248-28-4

FDA UNII

  • 774C760V46

System Generated Number

  • 0007248284

Structure Descriptors

InChI

1S/C21H22N2O3/c24-18-10-16-19-13-9-17-21(6-7-23(17,25)11-12(13)5-8-26-16)14-3-1-2-4-15(14)22(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+,23?/m0/s1

InChIKey

ADTDBAKUQAKBGZ-VXJIXCKJSA-N

Smiles

N12[C@@H]3[C@@]4([C@H]5[N@@](CC=6[C@@H](C5)[C@H]3[C@@H](OCC6)CC1=O)(=O)CC4)c1c2cccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 24500ug/kg (24.5mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 207, Pg. 688, 1949.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.080 (none)   EST
Water Solubility 1.86E+04 mg/L 22 EXP
Atmospheric OH Rate Constant 2.15E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.