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Substance Name: Estra-1,3,5(10)-triene-3,17-beta-diol, 17-(3,3,3-trifluoro-1-propynyl)-
RN: 2061-56-5
InChIKey: SZQHIOPVLPMIPS-ZWQJFZRQSA-N

Classification Codes

  • Hormone
  • Reproductive Effect

Molecular Formula

  • C21-H23-F3-O2

Molecular Weight

  • 364.405
 
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Names and Synonyms

Synonyms

  • 17-(3,3,3-Trifluoro-1-propynyl)estra-1,3,5(10)-trien-3,17-beta-diol
  • BDH 6146
  • BRN 2015407
  • Estra-1,3,5(10)-trien-3,17-diol, 3-methoxy-17-(3,3,3-trifluoro-1-propynyl)-, (17-beta)-

Systematic Name

  • Estra-1,3,5(10)-triene-3,17-beta-diol, 17-(3,3,3-trifluoro-1-propynyl)-

Registry Numbers

CAS Registry Number

  • 2061-56-5

System Generated Number

  • 0002061565

Structure Descriptors

InChI

1S/C21H23F3O2/c1-19-8-6-16-15-5-3-14(25)12-13(15)2-4-17(16)18(19)7-9-20(19,26)10-11-21(22,23)24/h3,5,12,16-18,25-26H,2,4,6-9H2,1H3/t16?,17?,18?,19?,20-/m1/s1

InChIKey

SZQHIOPVLPMIPS-ZWQJFZRQSA-N

Smiles

C(C(F)(F)F)#C[C@@]1([C@@]2([C@@H]([C@@H]3[C@@H](c4c(cc(O)cc4)CC3)CC2)CC1)C)O