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Substance Name: 1-Oxaspiro(4.5)dec-3-en-2-one, 4-(hydroxy(2-methylphenyl)methyl)-3-methyl-
RN: 86560-20-5
InChIKey: MYAIIZRLPDYOOT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H22-O3

Molecular Weight

  • 286.3688
 
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Names and Synonyms

Synonyms

  • 2-Methylhydroxybenzyl-3 methyl-2 cyclohexane spiro-4,4-butene-2 olide-4
  • 2-Methylhydroxybenzyl-3 methyl-2 cyclohexane spiro-4,4-butene-2 olide-4 [French]
  • 4-(Hydroxy(2-methylphenyl)methyl)-3-methyl-1-oxaspiro(4.5)dec-3-en-2-one
  • BRN 5085591

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 86560-20-5

System Generated Number

  • 0086560205

Structure Descriptors

InChI

1S/C18H22O3/c1-12-8-4-5-9-14(12)16(19)15-13(2)17(20)21-18(15)10-6-3-7-11-18/h4-5,8-9,16,19H,3,6-7,10-11H2,1-2H3

InChIKey

MYAIIZRLPDYOOT-UHFFFAOYSA-N

Smiles

Cc1ccccc1C(C2=C(C(=O)OC23CCCCC3)C)O

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.