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Substance Name: Bulbocapnine methiodide
RN: 5787-06-4
InChIKey: WLDVNQXUNGUNAF-ZOWNYOTGSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H22-N-O4.I

Molecular Weight

  • 467.2968
 
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Names and Synonyms

Results Name

  • Bulbocapnine methiodide

Synonyms

  • 6a-alpha-Aporphinium, 11-hydroxy-6-methyl-10-methoxy-1,2-(methylenedioxy)-, iodide
  • Bulbocapnine methiodide
  • N-Methylbulbocapninium iodide

Systematic Name

  • 5H-Benzo(g)-1,3-benzodioxolo(6,5,4-de)quinolinium, 6,7,7a,8-tetrahydro-12-hydroxy-11-methoxy-7-methyl-, iodide, (S)-

Registry Numbers

CAS Registry Number

  • 5787-06-4

System Generated Number

  • 0005787064

Molecular Formulas

Molecular Formula

  • C20-H22-N-O4.I

Molecular Formula Fragments

  • C20-H22-N-O4
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C20H21NO4.HI/c1-21(2)7-6-12-9-15-20(25-10-24-15)18-16(12)13(21)8-11-4-5-14(23-3)19(22)17(11)18;/h4-5,9,13H,6-8,10H2,1-3H3;1H/t13-;/m0./s1

InChIKey

WLDVNQXUNGUNAF-ZOWNYOTGSA-N

Smiles

[N+]1(CCc2c3c(c4c(C[C@H]13)ccc(c4O)OC)c1OCOc1c2)(C)C.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD intraperitoneal > 50mg/kg (50mg/kg) BEHAVIORAL: TREMOR

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal Chemistry. Vol. 13, Pg. 640, 1970.