(8R,9S,13S,14S,17R)-17-ethynyl-2-fluoro-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
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![(8R,9S,13S,14S,17R)-17-ethynyl-2-fluoro-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9fb3bf649fda4b69992fe44cfb92b23f.png "(8R,9S,13S,14S,17R)-17-ethynyl-2-fluoro-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol")
(8R,9S,13S,14S,17R)-17-ethynyl-2-fluoro-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
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CAS No:
22165-49-7
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Formula:
C20H23FO2
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Chemical Name:
(8R,9S,13S,14S,17R)-17-ethynyl-2-fluoro-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
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Synonyms:
2-FEE2;2-fluoro-17 alpha-ethynyloestradiol;2-fluoro-17-ethynylestradiol;22165-49-7;2-FEE2;2-Fluoro-17-ethynylestradiol;CHEMBL1627943;SCHEMBL10897827;DTXSID60944815;2-Fluoro-17alpha-ethynyloestradiol;2-Fluoro-17-ethynyl-17beta-estradiol;2-Fluoro-19-norpregna-1(10),2,4-trien-20-yne-3,17-diol;19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, 2-fluoro-, (17alpha)-
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CAS No:
(8R,9S,13S,14S,17R)-17-ethynyl-2-fluoro-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol Basic Attributes
314.4 g/mol
314.16820813 g/mol
Computed Properties
Molecular Weight:314.4
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:314.16820813
Monoisotopic Mass:314.16820813
Topological Polar Surface Area:40.5
Heavy Atom Count:23
Complexity:539
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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