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Substance Name: CCD 3693
RN: 177080-77-2
InChIKey: BLMOPJSSNJGYSZ-PECKBWEZSA-N

Molecular Formula

  • C22-H33-F3-O2

Molecular Weight

  • 386.495
 
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Names and Synonyms

Name of Substance

  • CCD 3693

Synonyms

  • 3alpha-Hydroxy-3beta-(trifluoromethyl)-5alpha-pregnan-20-one
  • 3alpha-Hydroxy-3beta-trifluoromethyl-5alpha-pregnan-20-one
  • Ccd-3693
  • Co 2-1970

Systematic Name

  • Pregnan-20-one, 3-hydroxy-3-(trifluoromethyl)-, (3alpha,5alpha)-

Registry Numbers

CAS Registry Number

  • 177080-77-2

System Generated Number

  • 0177080772

Structure Descriptors

InChI

1S/C22H33F3O2/c1-13(26)16-6-7-17-15-5-4-14-12-21(27,22(23,24)25)11-10-19(14,2)18(15)8-9-20(16,17)3/h14-18,27H,4-12H2,1-3H3/t14-,15-,16+,17-,18-,19-,20+,21-/m0/s1

InChIKey

BLMOPJSSNJGYSZ-PECKBWEZSA-N

Smiles

C1[C@](C[C@@H]2CC[C@H]3[C@@H]4CC[C@@H](C(C)=O)[C@@]4(C)CC[C@H]3[C@@]2(C1)C)(C(F)(F)F)O