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Substance Name: 4-Fluoro-2-hydroxyestradiol
RN: 148044-30-8
InChIKey: FMHAFUXKLBNHPP-ZICKVNAASA-N

Note

  • Mediator of hormonol carcinogenesis.

Molecular Formula

  • C18-H23-F-O3

Molecular Weight

  • 306.3747
 
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Names and Synonyms

Name of Substance

  • 4-Fluoro-2-hydroxyestradiol

Synonym

  • 4F2OHE2

Systematic Name

  • Estra-1,3,5(10)-triene-2,3,17-triol, 4-fluoro-, (17beta)-

Registry Numbers

CAS Registry Number

  • 148044-30-8

System Generated Number

  • 0148044308

Structure Descriptors

InChI

1S/C18H23FO3/c1-18-7-6-9-10(13(18)4-5-15(18)21)2-3-11-12(9)8-14(20)17(22)16(11)19/h8-10,13,15,20-22H,2-7H2,1H3/t9-,10+,13-,15-,18-/m0/s1

InChIKey

FMHAFUXKLBNHPP-ZICKVNAASA-N

Smiles

C[C@]12CC[C@H]3[C@@H](CCc4c(F)c(O)c(O)cc34)[C@@H]1CC[C@@H]2O