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Substance Name: 11-Ethyl-16-fluoroestradiol
RN: 129000-39-1
InChIKey: BLLQFETUFOJMGB-PVPZMVGNSA-N

Molecular Formula

  • C20-H27-F-O2

Molecular Weight

  • 318.4293
 
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Names and Synonyms

Name of Substance

  • 11-Ethyl-16-fluoroestradiol

Synonyms

  • (11beta,16alpha,17beta)-11-Ethyl-16-fluoroestra-1,3,5(10)-triene-3,17-diol
  • 11-Et-Fes

Systematic Name

  • Estra-1,3,5(10)-triene-3,17-diol, 11-ethyl-16-fluoro-, (11beta,16alpha,17beta)-

Registry Numbers

CAS Registry Number

  • 129000-39-1

System Generated Number

  • 0129000391

Structure Descriptors

InChI

1S/C20H27FO2/c1-3-11-10-20(2)16(9-17(21)19(20)23)15-6-4-12-8-13(22)5-7-14(12)18(11)15/h5,7-8,11,15-19,22-23H,3-4,6,9-10H2,1-2H3/t11-,15-,16-,17+,18+,19-,20-/m0/s1

InChIKey

BLLQFETUFOJMGB-PVPZMVGNSA-N

Smiles

CC[C@H]1C[C@]2(C)[C@@H](O)[C@H](F)C[C@H]2[C@@H]3CCc4cc(O)ccc4[C@@H]13