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Substance Name: 2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-3,6,11-trimethyl-, hydrobromide(2R-(2-alpha,6-alpha,11R*))-
RN: 112295-90-6
InChIKey: PVDXGHHWBNWJAB-HFQRBXEFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H21-N-O.Br-H

Molecular Weight

  • 312.2488
 
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Names and Synonyms

Synonyms

  • (+-)-2'-Hydroxy-2,5,9-trimethyl-6,7-benzomorphan hydrobromide
  • NIH 7569
  • UM 743

Systematic Name

  • 2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-3,6,11-trimethyl-, hydrobromide(2R-(2-alpha,6-alpha,11R*))-

Registry Numbers

CAS Registry Number

  • 112295-90-6

System Generated Number

  • 0112295906

Molecular Formulas

Molecular Formula

  • C15-H21-N-O.Br-H

Molecular Formula Fragments

  • Br-H
  • C15-H21-N-O
  • COMPONENT

Structure Descriptors

InChI

1S/C15H21NO.BrH/c1-10-14-8-11-4-5-12(17)9-13(11)15(10,2)6-7-16(14)3;/h4-5,9-10,14,17H,6-8H2,1-3H3;1H/t10-,14+,15+;/m0./s1

InChIKey

PVDXGHHWBNWJAB-HFQRBXEFSA-N

Smiles

C[C@H]1[C@H]2Cc3ccc(cc3[C@@]1(CCN2C)C)O.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous > 400mg/kg (400mg/kg)   Journal of Organic Chemistry. Vol. 24, Pg. 1435, 1959.