(8S,9S,10R,13R,14S,17S)-6-fluoro-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
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![(8S,9S,10R,13R,14S,17S)-6-fluoro-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/93b266ce3983409b916e8377bffa628b.png "(8S,9S,10R,13R,14S,17S)-6-fluoro-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol")
(8S,9S,10R,13R,14S,17S)-6-fluoro-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
structure -
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CAS No:
86361-68-4
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Formula:
C27H45FO
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Chemical Name:
(8S,9S,10R,13R,14S,17S)-6-fluoro-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
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Synonyms:
6-FLCS;6-fluorocholesterol;86361-68-4;6-Flcs;6-Fluorocholest-5-en-3-ol;(8S,9S,10R,13R,14S,17S)-6-fluoro-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol;DTXSID101006765;Cholest-5-en-3-ol, 6-fluoro-, (3beta)-
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CAS No:
(8S,9S,10R,13R,14S,17S)-6-fluoro-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol Basic Attributes
404.6 g/mol
404.34544422 g/mol
Computed Properties
Molecular Weight:404.6
XLogP3:8.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:404.34544422
Monoisotopic Mass:404.34544422
Topological Polar Surface Area:20.2
Heavy Atom Count:29
Complexity:638
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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