Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Butaclamol hydrochloride [USAN]
RN: 36504-94-6
UNII: 8TUG8SF12T
InChIKey: QZRUMKUMFJJARD-OMMJFLKZSA-N

Note

  • A benzocycloheptapyridoisoquinolinol that has been used as an antipsychotic, especially in schizophrenia.

Molecular Formula

  • C25-H31-N-O.Cl-H

Molecular Weight

  • 397.987
 

Classification Codes

  • Antipsychotic
  • Drug / Therapeutic Agent
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Butaclamol hydrochloride [USAN]

Synonyms

  • (+-)-3alpha-tert-Butyl-2,3,4,4abeta,8,9,13balpha,14-octahydro-1H-benzo(6,7)-cyclohepta(1,2,3-de)pyrido(2,1-a)isoquinolin-3-ol hydrochloride
  • 1H-Benzo(6,7)cyclohepta(1,2,3-de)-pyrido(2,1-a)isoquinolin-3-ol, 3-(1,1-dimethylethyl)-2,3,4,4a,8,9,13b,14-octahydro-, hydrochloride, (3alpha,4aalpha,13bbeta)-(+-)-
  • AY 23028
  • AY-23,028
  • Butaclamol HCl
  • Butaclamol hydrochloride
  • UNII-8TUG8SF12T

Systematic Names

  • 1H-Benzo(6,7)cyclohepta(1,2,3-de)-pyrido(2,1-a)isoquinolin-3-ol, 3-(1,1-dimethylethyl)-2,3,4,4a,8,9,13b,14-octahydro-, hydrochloride, (3alpha,4aalpha,13bbeta)-(+-)-
  • 1H-Benzo(6,7)cyclohepta(1,2,3-de)pyrido(2,1-alpha)isoquinolin-3-ol, 2,3,4,4a,8,9,13b,14-octahydro-3-(1,1-dimethylethyl)-, hydrochloride, (3-alpha,4a-alpha,13b-beta)-(+-)-

Registry Numbers

CAS Registry Number

  • 36504-94-6

FDA UNII

  • 8TUG8SF12T

Related Registry Number

  • 36504-93-5 (Parent)

System Generated Number

  • 0036504946

Molecular Formulas

Molecular Formula

  • C25-H31-N-O.Cl-H

Molecular Formula Fragments

  • C25-H31-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H31NO.ClH/c1-24(2,3)25(27)13-14-26-16-21-19-9-5-4-7-17(19)11-12-18-8-6-10-20(23(18)21)22(26)15-25;/h4-10,21-22,27H,11-16H2,1-3H3;1H/t21-,22-,25-;/m1./s1

InChIKey

QZRUMKUMFJJARD-OMMJFLKZSA-N

Smiles

c12[C@H]3c4c(cccc4)CCc2cccc1[C@H]1C[C@](C(C)(C)C)(O)CC[N@@]1C3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 195mg/kg (195mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 33, Pg. 1417, 1983.