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Substance Name: Veratramine, N-butyl-, hydrochloride
RN: 105043-98-9
InChIKey: GYUPPMIIXOQDCB-FFRVBXERSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H47-N-O2.Cl-H

Molecular Weight

  • 502.1782
 
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Names and Synonyms

Synonym

  • N-Butylveratramine hydrochloride

Systematic Name

  • Veratramine, N-butyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 105043-98-9

System Generated Number

  • 0105043989

Molecular Formulas

Molecular Formula

  • C31-H47-N-O2.Cl-H

Molecular Formula Fragments

  • C31-H47-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C31H47NO2.ClH/c1-6-7-14-32-18-19(2)15-29(34)30(32)21(4)24-10-11-25-26-9-8-22-16-23(33)12-13-31(22,5)28(26)17-27(25)20(24)3;/h8,10-11,19,21,23,26,28-30,33-34H,6-7,9,12-18H2,1-5H3;1H/t19-,21-,23-,26-,28-,29+,30-,31-;/m0./s1

InChIKey

GYUPPMIIXOQDCB-FFRVBXERSA-N

Smiles

CCCCN1C[C@H](C[C@H]([C@@H]1[C@@H](C)c2ccc3c(c2C)C[C@H]4[C@H]3CC=C5[C@@]4(CC[C@@H](C5)O)C)O)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 3623ug/kg (3.623mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 145, Pg. 275, 1964.