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Substance Name: WV 1117
RN: 16825-88-0
InChIKey: ABIMQABPHAQAIH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H27-N-O3.Cl-H

Molecular Weight

  • 329.865
 
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Names and Synonyms

Results Name

  • WV 1117

Synonyms

  • 5-(2-(Dimethylamino)propoxy)carvacrol acetate (ester) hydrochloride
  • WV 1117

Systematic Name

  • Carvacrol, 5-(2-(dimethylamino)propoxy)-, acetate (ester), hydrochloride

Registry Numbers

CAS Registry Number

  • 16825-88-0

System Generated Number

  • 0016825880

Molecular Formulas

Molecular Formula

  • C17-H27-N-O3.Cl-H

Molecular Formula Fragments

  • C17-H27-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H27NO3.ClH/c1-11(2)15-9-16(21-14(5)19)12(3)8-17(15)20-10-13(4)18(6)7;/h8-9,11,13H,10H2,1-7H3;1H

InChIKey

ABIMQABPHAQAIH-UHFFFAOYSA-N

Smiles

C(C)(=O)Oc1cc(C(C)C)c(cc1C)OC[C@@H](C)N(C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous > 100mg/kg (100mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 17, Pg. 305, 1967.