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Substance Name: 2H-Thieno(2,3-c)(1)benzopyran-9-ol, 1,4-dihydro-7-(1,2-dimethylheptyl)-4,4-dimethyl-
RN: 26622-10-6
InChIKey: PZDFHHSXZRIAEF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H32-O2-S

Molecular Weight

  • 360.559
 
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Names and Synonyms

Synonyms

  • 1,4-Dihydro-7-(1,2-dimethylheptyl)-4,4-dimethyl-2H-thieno(2,3-c)(1)benzopyran-9-ol
  • BRN 1325044

Systematic Name

  • 2H-Thieno(2,3-c)(1)benzopyran-9-ol, 1,4-dihydro-7-(1,2-dimethylheptyl)-4,4-dimethyl-

Registry Numbers

CAS Registry Number

  • 26622-10-6

System Generated Number

  • 0026622106

Structure Descriptors

InChI

1S/C22H32O2S/c1-6-7-8-9-14(2)15(3)16-12-18(23)20-17-10-11-25-21(17)22(4,5)24-19(20)13-16/h12-15,23H,6-11H2,1-5H3

InChIKey

PZDFHHSXZRIAEF-UHFFFAOYSA-N

Smiles

C1(C2=C(c3c(O1)cc(cc3O)[C@@H]([C@@H](CCCCC)C)C)CCS2)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 300mg/kg (300mg/kg)   Journal of Medicinal Chemistry. Vol. 19, Pg. 549, 1976.