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Substance Name: Diethylstilbestrol quinone
RN: 5664-37-9
InChIKey: LKSFYQFTIVHZAP-UHFFFAOYSA-N

Note

  • Postulated metabolic intermediate in diethylstilbestrol metabolism.

Classification Code

  • Mutation Data

Molecular Formula

  • C18-H18-O2

Molecular Weight

  • 266.3382
 
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Names and Synonyms

Name of Substance

  • Diethylstilbestrol quinone

Synonyms

  • 4,4'-(Diethylethanediylidene)di-2,5-cyclohexadien-1-one
  • BRN 5952518
  • Diethylstilbestrol quinone
  • Diethylstilbestrol-4',4''-quinone
  • Stilbestrol quinone

Systematic Names

  • 2,5-Cyclohexadien-1-one, 4,4'-(1,2-diethyl-1,2-ethanediylidene)bis- (9CI)
  • 2,5-Cyclohexadien-1-one, 4,4'-(diethylethanediylidene)di-

Registry Numbers

CAS Registry Number

  • 5664-37-9

System Generated Number

  • 0005664379

Structure Descriptors

InChI

1S/C18H18O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12H,3-4H2,1-2H3

InChIKey

LKSFYQFTIVHZAP-UHFFFAOYSA-N

Smiles

CCC(=C1C=CC(=O)C=C1)C(=C2C=CC(=O)C=C2)CC