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Substance Name: 17-Iodovinyl-11-ethylestradiol
RN: 149046-54-8
InChIKey: UYRBVLDGMNORHN-XUOOYTPCSA-N

Note

  • A radioligand for estrogen receptors.

Molecular Formula

  • C22-H29-I-O2

Molecular Weight

  • 452.369
 
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Names and Synonyms

Name of Substance

  • 17-Iodovinyl-11-ethylestradiol

Synonym

  • 17alpha-Iodovinyl-11beta-ethylestradiol

Systematic Name

  • 19-Norpregna-1,3,5(10),20-tetraene-3,17-diol, 11-ethyl-21-iodo-, (11beta,17alpha,20E)-

Registry Numbers

CAS Registry Number

  • 149046-54-8

System Generated Number

  • 0149046548

Structure Descriptors

InChI

1S/C22H29IO2/c1-3-14-13-21(2)19(8-9-22(21,25)10-11-23)18-6-4-15-12-16(24)5-7-17(15)20(14)18/h5,7,10-12,14,18-20,24-25H,3-4,6,8-9,13H2,1-2H3/b11-10+/t14-,18-,19-,20+,21-,22+/m0/s1

InChIKey

UYRBVLDGMNORHN-XUOOYTPCSA-N

Smiles

c1c(cc2CC[C@@H]3[C@@H](c2c1)[C@@H](CC)C[C@@]1([C@H]3CC[C@@]1(\C=C\I)O)C)O