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Substance Name: Ethanone, 1-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)-
RN: 41757-95-3
InChIKey: XNJYHEGDUAQGEE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H22-O6

Molecular Weight

  • 310.3438
 
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Names and Synonyms

Synonyms

  • 1-(2,3,5,6,8,9,11,12-Octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)ethanone
  • BRN 1595254
  • Cetylbenzo-15-crown-5

Systematic Name

  • Ethanone, 1-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)-

Registry Numbers

CAS Registry Number

  • 41757-95-3

System Generated Number

  • 0041757953

Structure Descriptors

InChI

1S/C16H22O6/c1-13(17)14-2-3-15-16(12-14)22-11-9-20-7-5-18-4-6-19-8-10-21-15/h2-3,12H,4-11H2,1H3

InChIKey

XNJYHEGDUAQGEE-UHFFFAOYSA-N

Smiles

CC(=O)c1ccc2c(c1)OCCOCCOCCOCCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 270mg/kg (270mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 164, 1989.