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Substance Name: 2-Cycloocten-1-one, 3,7-dimethyl-6-(3-methyl-1-oxo-2-butenyl)-, trans-(-)-
RN: 151484-84-3
InChIKey: QSEXTUGQYXMUHW-YTYACIELSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C15-H22-O2

Molecular Weight

  • 234.337
 
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Names and Synonyms

Synonyms

  • Spartidienedione
  • trans-(-)-3,7-Dimethyl-6-(3-methyl-1-oxo-2-butenyl)-2-cycloocten-1-one

Systematic Name

  • 2-Cycloocten-1-one, 3,7-dimethyl-6-(3-methyl-1-oxo-2-butenyl)-, trans-(-)-

Registry Numbers

CAS Registry Number

  • 151484-84-3

System Generated Number

  • 0151484843

Structure Descriptors

InChI

1S/C15H22O2/c1-10(2)7-15(17)14-6-5-11(3)8-13(16)9-12(14)4/h7-8,12,14H,5-6,9H2,1-4H3/b11-8-/t12-,14-/m1/s1

InChIKey

QSEXTUGQYXMUHW-YTYACIELSA-N

Smiles

C1(C=C(CC[C@H]([C@@H](C1)C)C(\C=C(\C)C)=O)C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 5gm/kg (5000mg/kg)   International Journal of Pharmacognosy. Vol. 34, Pg. 179, 1996.