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Substance Name: 2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-tetrahydrofurfuryl-, hydrochloride, (2S,6S,11R,2'S)-
RN: 57286-97-2
InChIKey: XOZIUUNFGMUEJB-NDKOGGNSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H27-N-O2.Cl-H

Molecular Weight

  • 337.8882
 
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Names and Synonyms

Synonym

  • (1S,5S,9R,2''S)-5,9-Dimethyl-2'-hydroxy-2-tetrahydrofurfuryl-6,7-benzomorphan hydrochloride

Systematic Name

  • 2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-tetrahydrofurfuryl-, hydrochloride, (2S,6S,11R,2'S)-

Registry Numbers

CAS Registry Number

  • 57286-97-2

System Generated Number

  • 0057286972

Molecular Formulas

Molecular Formula

  • C19-H27-N-O2.Cl-H

Molecular Formula Fragments

  • C19-H27-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H27NO2.ClH/c1-13-18-10-14-5-6-15(21)11-17(14)19(13,2)7-8-20(18)12-16-4-3-9-22-16;/h5-6,11,13,16,18,21H,3-4,7-10,12H2,1-2H3;1H/t13?,16-,18+,19+;/m0./s1

InChIKey

XOZIUUNFGMUEJB-NDKOGGNSSA-N

Smiles

CC1[C@H]2Cc3ccc(cc3[C@@]1(CCN2C[C@@H]4CCCO4)C)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 140mg/kg (140mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 996, 1975.