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Substance Name: Strychnidin-10-one, 21,22-dihydro-, (21-alpha)- (9CI)
RN: 15006-14-1
InChIKey: LUMNFZCZEDAQNJ-QDPSZFTISA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H24-N2-O2

Molecular Weight

  • 336.433
 
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Names and Synonyms

Synonyms

  • (21-alpha)-21,22-Dihydrostrychnidin-10-one
  • 21,22-Dihydrostrychnine
  • 21-alpha,22-Dihydrostrychnidin-10-one
  • Dihydrostrychnine

Systematic Names

  • Strychnidin-10-one, 21,22-dihydro-, (21-alpha)- (9CI)
  • Strychnine, 21,22-dihydro-

Registry Numbers

CAS Registry Number

  • 15006-14-1

System Generated Number

  • 0015006141

Structure Descriptors

InChI

1S/C21H24N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-4,12-13,16-17,19-20H,5-11H2/t12-,13+,16+,17+,19+,20+,21-/m1/s1

InChIKey

LUMNFZCZEDAQNJ-QDPSZFTISA-N

Smiles

C1[N@@]2[C@H]3C[C@@H]4[C@H]5[C@@H](OCC[C@@H]4C2)CC(N2c4c([C@@]3(C1)[C@H]52)cccc4)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 7280ug/kg (7.28mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Acta Pharmaceutica Suecica. Vol. 15, Pg. 431, 1978.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.62 (none)   EXP
Water Solubility 309 mg/L 25 EST
Vapor Pressure 3.84E-09 mm Hg 25 EST
Henry's Law Constant 7.23E-15 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.45E-10 cm3/molecule-sec 25 EST

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