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Substance Name: Itaconylanabasine
RN: 73167-05-2
InChIKey: JAOCVEPNMXWSTI-ZDUSSCGKSA-N

Molecular Formula

  • C15-H18-N2-O3

Molecular Weight

  • 274.3182
 
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Names and Synonyms

Results Name

  • Itaconylanabasine

Synonyms

  • (S)-alpha-Methylene-gamma-oxo-2-(3-pyridinyl)-1-piperidinebutanoic acid
  • Itaconylanabasine

Systematic Name

  • 1-Piperidinebutanoic acid, alpha-methylene-gamma-oxo-2-(3-pyridinyl)-, (S)-

Registry Numbers

CAS Registry Number

  • 73167-05-2

System Generated Number

  • 0073167052

Structure Descriptors

InChI

1S/C15H18N2O3/c1-11(15(19)20)9-14(18)17-8-3-2-6-13(17)12-5-4-7-16-10-12/h4-5,7,10,13H,1-3,6,8-9H2,(H,19,20)/t13-/m0/s1

InChIKey

JAOCVEPNMXWSTI-ZDUSSCGKSA-N

Smiles

C=C(CC(=O)N1CCCC[C@H]1c2cccnc2)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 23mg/kg (23mg/kg)   U.S.S.R. Patent Document. Vol. #0706415,