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Substance Name: Lobeline sulfate
RN: 134-64-5
UNII: 4CJ480V2HP
InChIKey: GRZMOSSVIPFGFF-GNJLJDPWSA-N

Molecular Formula

  • C22-H27-N-O2.1/2H2-O4-S

Molecular Weight

  • 772.9984
 
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Names and Synonyms

Name of Substance

  • Lobeline sulfate

Synonyms

  • Bantron
  • EINECS 205-151-8
  • Lobelin sulfate
  • Lobeline sulfate
  • UNII-4CJ480V2HP

Systematic Names

  • Ethanone, 2-(6-(2-hydroxy-2-phenylethyl)-1-methyl-2-piperidinyl)-1-phenyl-, (2theta-(2alpha,6alpha(S)))-, sulfate (2:1) (salt)
  • Lobeline sulphate
  • Lobeline, sulfate (2:1) (salt)

Registry Numbers

CAS Registry Number

  • 134-64-5

FDA UNII

  • 4CJ480V2HP

System Generated Number

  • 0000134645

Molecular Formulas

Molecular Formula

  • C22-H27-N-O2.1/2H2-O4-S

Molecular Formula Fragments

  • C22-H27-N-O2
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/2C22H27NO2.H2O4S/c2*1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18;1-5(2,3)4/h2*2-7,9-12,19-21,24H,8,13-16H2,1H3;(H2,1,2,3,4)/t2*19-,20+,21-;/m00./s1

InChIKey

GRZMOSSVIPFGFF-GNJLJDPWSA-N

Smiles

CN1[C@@H](CCC[C@@H]1CC(=O)c2ccccc2)C[C@@H](c3ccccc3)O.CN1[C@@H](CCC[C@@H]1CC(=O)c2ccccc2)C[C@@H](c3ccccc3)O.OS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 55300ug/kg (55.3mg/kg)   Veterinary and Human Toxicology. Vol. 27, Pg. 1, 1985.
pigeon LDLo subcutaneous 54600ug/kg (54.6mg/kg)   "Ueber die Wirkung Verschiedener Gifte Auf Vogel, Dissertation," Forchheimer, L., Pharmakologischen Institut der Universitat Wurzburg, Fed. Rep. Ger., 1931Vol. -, Pg. -, 1931.