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Substance Name: Cyclopenta(c)(1)benzopyran-9-ol, 1,2,3,4-tetrahydro-7-(1,2-dimethylheptyl)-1,4,4-trimethyl-
RN: 55877-00-4
InChIKey: MSUHGDQBGRIICK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H36-O2

Molecular Weight

  • 356.5464
 
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Names and Synonyms

Synonyms

  • 1,2,3,4-Tetrahydro-7-(1,2-dimethylheptyl)-1,4,4-trimethylcyclopenta(c)(1)benzopyran-9-ol
  • 7-(1,2-Dimethylheptyl)-9-hydroxy-1,2,3,4-tetrahydro-1,4,4-trimethylcyclopenta(c)(1)benzopyran
  • BRN 1593641

Systematic Name

  • Cyclopenta(c)(1)benzopyran-9-ol, 1,2,3,4-tetrahydro-7-(1,2-dimethylheptyl)-1,4,4-trimethyl-

Registry Numbers

CAS Registry Number

  • 55877-00-4

System Generated Number

  • 0055877004

Structure Descriptors

InChI

1S/C24H36O2/c1-7-8-9-10-15(2)17(4)18-13-20(25)23-21(14-18)26-24(5,6)19-12-11-16(3)22(19)23/h13-17,25H,7-12H2,1-6H3

InChIKey

MSUHGDQBGRIICK-UHFFFAOYSA-N

Smiles

CCCCCC(C)C(C)c1cc(c2c(c1)OC(C3=C2C(CC3)C)(C)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 500mg/kg (500mg/kg)   Journal of Medicinal Chemistry. Vol. 19, Pg. 552, 1976.