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Substance Name: 1-Oxaspiro(4.5)dec-3-en-2-one, 4-benzoyl-3-methyl-
RN: 86560-06-7
InChIKey: VDAHQJXRSPCMTL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H18-O3

Molecular Weight

  • 270.3262
 
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Names and Synonyms

Synonyms

  • 4-Benzoyl-3-methyl-1-oxaspiro(4.5)dec-3-en-2-one
  • Benzoyl-3 methyl-2 cyclohexane spiro-4,4-butene-2 olide-4
  • Benzoyl-3 methyl-2 cyclohexane spiro-4,4-butene-2 olide-4 [French]
  • BRN 5066308

Systematic Name

  • 1-Oxaspiro(4.5)dec-3-en-2-one, 4-benzoyl-3-methyl-

Registry Numbers

CAS Registry Number

  • 86560-06-7

System Generated Number

  • 0086560067

Structure Descriptors

InChI

1S/C17H18O3/c1-12-14(15(18)13-8-4-2-5-9-13)17(20-16(12)19)10-6-3-7-11-17/h2,4-5,8-9H,3,6-7,10-11H2,1H3

InChIKey

VDAHQJXRSPCMTL-UHFFFAOYSA-N

Smiles

CC1=C(C2(CCCCC2)OC1=O)C(=O)c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2gm/kg (2000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 18, Pg. 147, 1983.