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Substance Name: Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(3-benzoylpropyl)-, dl-
RN: 42021-39-6
InChIKey: QIRUTDIHRCMUHE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H27-N3-O

Molecular Weight

  • 373.4973
 
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Names and Synonyms

Synonym

  • dl-2-(2-Phenacylethyl)-1,2,3,4,6,7,12,12a-octahydro(2',1':6,1)pyrido(3,4-b)indole

Systematic Name

  • Pyrazino(1',2':1,6)pyrido(3,4-b)indole, 1,2,3,4,6,7,12,12a-octahydro-2-(3-benzoylpropyl)-, dl-

Registry Numbers

CAS Registry Number

  • 42021-39-6

System Generated Number

  • 0042021396

Structure Descriptors

InChI

1S/C24H27N3O/c28-24(18-7-2-1-3-8-18)11-6-12-26-13-14-27-17-23-21(15-19(27)16-26)20-9-4-5-10-22(20)25-23/h1-5,7-10,19,25H,6,11-17H2

InChIKey

QIRUTDIHRCMUHE-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C(=O)CCCN2CCN3Cc4c(c5ccccc5[nH]4)CC3C2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 560, 1973.