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Substance Name: 1H-3a,8-Methanodibenzo(3,4:6,7)cyclohepta(1,2-c)pyrrole, 2,3,8,12b-tetrahydro-2-(cyclohexylmethyl)-8-methyl-, hydrochloride, (3a-alpha,8-alpha,12b-beta)-
RN: 66691-66-5
InChIKey: QBXXZJJZZAXSRP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H31-N.Cl-H

Molecular Weight

  • 393.9988
 
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Names and Synonyms

  • 1H-3a,8-Methanodibenzo(3,4:6,7)cyclohepta(1,2-c)pyrrole, 2,3,8,12b-tetrahydro-2-(cyclohexylmethyl)-8-methyl-, hydrochloride, (3a-alpha,8-alpha,12b-beta)-

Registry Numbers

CAS Registry Number

  • 66691-66-5

System Generated Number

  • 0066691665

Molecular Formulas

Molecular Formula

  • C26-H31-N.Cl-H

Molecular Formula Fragments

  • C26-H31-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H31N.ClH/c1-25-17-26(23-14-8-7-13-22(23)25)18-27(15-19-9-3-2-4-10-19)16-24(26)20-11-5-6-12-21(20)25;/h5-8,11-14,19,24H,2-4,9-10,15-18H2,1H3;1H

InChIKey

QBXXZJJZZAXSRP-UHFFFAOYSA-N

Smiles

CC12CC3(CN(CC3c4c1cccc4)CC5CCCCC5)c6c2cccc6.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 324mg/kg (324mg/kg)   United States Patent Document. Vol. #4076830,