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Substance Name: 7-(5-Fluoropentyl)estradiol
RN: 150187-33-0
InChIKey: BMKNHWLYRPVVGC-LSFZQJMJSA-N

Note

  • Ligand for the study of estrogen receptor.

Molecular Formula

  • C23-H33-F-O2

Molecular Weight

  • 360.5097
 
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Names and Synonyms

Name of Substance

  • 7-(5-Fluoropentyl)estradiol

Systematic Name

  • Estra-1,3,5(10)-triene-3,17-diol, 7-(5-fluoropentyl)-, (7alpha,17beta)-

Registry Numbers

CAS Registry Number

  • 150187-33-0

System Generated Number

  • 0150187330

Structure Descriptors

InChI

1S/C23H33FO2/c1-23-11-10-19-18-7-6-17(25)14-16(18)13-15(5-3-2-4-12-24)22(19)20(23)8-9-21(23)26/h6-7,14-15,19-22,25-26H,2-5,8-13H2,1H3/t15-,19-,20+,21+,22-,23+/m1/s1

InChIKey

BMKNHWLYRPVVGC-LSFZQJMJSA-N

Smiles

C[C@]12CC[C@H]3[C@@H]([C@H](CCCCCF)Cc4cc(O)ccc34)[C@@H]1CC[C@@H]2O