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Substance Name: Butanoic acid, 4-((5-(1,2-dithiolan-3-yl)-1-oxopentyl)amino)-
RN: 59547-52-3
InChIKey: PZSMUPGANZGPBF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Weight

  • 291.434
 
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Names and Synonyms

Synonyms

  • 4-((5-(1,2-Dithiolan-3-yl)-1-oxopentyl)amino)butanoic acid
  • 4-(DL-alpha-Lipamido)butyric acid
  • LABA

Systematic Name

  • Butanoic acid, 4-((5-(1,2-dithiolan-3-yl)-1-oxopentyl)amino)-

Registry Numbers

CAS Registry Number

  • 59547-52-3

System Generated Number

  • 0059547523

Structure Descriptors

InChI

1S/C12H21NO3S2/c14-11(13-8-3-6-12(15)16)5-2-1-4-10-7-9-17-18-10/h10H,1-9H2,(H,13,14)(H,15,16)

InChIKey

PZSMUPGANZGPBF-UHFFFAOYSA-N

Smiles

C1[C@@H](SSC1)CCCCC(NCCCC(O)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 891mg/kg (891mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 85, Pg. 463, 1965.
mouse LD50 intravenous 889mg/kg (889mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 85, Pg. 463, 1965.
mouse LD50 oral 3860mg/kg (3860mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 85, Pg. 463, 1965.
mouse LD50 subcutaneous 832mg/kg (832mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 85, Pg. 463, 1965.