Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-[(1-oxo-9,12-octadecadienyl)oxy]-, [11β,16α,21(9Z,12Z)]-
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![Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-[(1-oxo-9,12-octadecadienyl)oxy]-, [11β,16α,21(9Z,12Z)]- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/18bf1a60fb13458181109bc1fdf8195b.png "Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-[(1-oxo-9,12-octadecadienyl)oxy]-, [11β,16α,21(9Z,12Z)]-")
Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-[(1-oxo-9,12-octadecadienyl)oxy]-, [11β,16α,21(9Z,12Z)]-
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CAS No:
39026-39-6
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Formula:
C40H59FO6
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Chemical Name:
Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-[(1-oxo-9,12-octadecadienyl)oxy]-, [11β,16α,21(9Z,12Z)]-
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Synonyms:
Pregna-1,4-diene-3,20-dione,9-fluoro-11,17-dihydroxy-16-methyl-21-[(1-oxo-9,12-octadecadienyl)oxy]-,[11β,16α,21(9Z,12Z)]-;Pregna-1,4-diene-3,20-dione,9-fluoro-11β,17,21-trihydroxy-16α-methyl-,21-linoleate;Dexamethasone 21-linoleate;ISF 2073;Dexamethasone linoleate;137076-97-2;58649-95-9
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CAS No:
Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-[(1-oxo-9,12-octadecadienyl)oxy]-, [11β,16α,21(9Z,12Z)]- Basic Attributes
654.9 g/mol
654.89
Computed Properties
Molecular Weight:654.9
XLogP3:9.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:18
Exact Mass:654.42956776
Monoisotopic Mass:654.42956776
Topological Polar Surface Area:101
Heavy Atom Count:47
Complexity:1250
Undefined Atom Stereocenter Count:8
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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