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Substance Name: 9-(Lupinylthio)xanthene
RN: 156171-17-4
InChIKey: HATRNZBPIOXPFY-FXAWDEMLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H27-N-O-S

Molecular Weight

  • 365.5383
 
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Names and Synonyms

Results Name

  • 9-(Lupinylthio)xanthene

Synonyms

  • (1R-trans)-Octahydro-1-((9H-xanthen-9-ylthio)methyl)-2H-quinolizine
  • 9-(Lupinylthio)xanthene

Systematic Name

  • 2H-Quinolizine, octahydro-1-((9H-xanthen-9-ylthio)methyl)-, (1R-trans)-

Registry Numbers

CAS Registry Number

  • 156171-17-4

System Generated Number

  • 0156171174

Structure Descriptors

InChI

1S/C23H27NOS/c1-3-12-21-18(9-1)23(19-10-2-4-13-22(19)25-21)26-16-17-8-7-15-24-14-6-5-11-20(17)24/h1-4,9-10,12-13,17,20,23H,5-8,11,14-16H2/t17-,20+/m0/s1

InChIKey

HATRNZBPIOXPFY-FXAWDEMLSA-N

Smiles

c1ccc2c(c1)C(c3ccccc3O2)SC[C@@H]4CCCN5[C@@H]4CCCC5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 100mg/kg (100mg/kg)   Farmaco. Vol. 48, Pg. 1021, 1993.
mouse LD oral > 300mg/kg (300mg/kg)   Farmaco. Vol. 48, Pg. 1021, 1993.