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Substance Name: Cyclopenta(c)(1)benzopyran-9-ol, 1,2,3,4-tetrahydro-4,4-dimethyl-7-(1,2-dimethylheptyl)-
RN: 35570-59-3
InChIKey: ZJNVIVRSORGHEF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H34-O2

Molecular Weight

  • 342.52
 
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Names and Synonyms

Synonyms

  • 1,2,3,4-Tetrahydro-4,4-dimethyl-7-(1,2-dimethylheptyl)cyclopenta(c)(1)benzopyran-9-ol
  • BRN 1222203

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 35570-59-3

System Generated Number

  • 0035570593

Structure Descriptors

InChI

1S/C23H34O2/c1-6-7-8-10-15(2)16(3)17-13-20(24)22-18-11-9-12-19(18)23(4,5)25-21(22)14-17/h13-16,24H,6-12H2,1-5H3

InChIKey

ZJNVIVRSORGHEF-UHFFFAOYSA-N

Smiles

C1(C2=C(c3c(O1)cc(cc3O)[C@@H]([C@@H](CCCCC)C)C)CCC2)(C)C

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.