[2-[(8S,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2-hydroxybenzoate
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[2-[(8S,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2-hydroxybenzoate
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CAS No:
65849-38-9
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Formula:
C28H31FO8
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Chemical Name:
[2-[(8S,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2-hydroxybenzoate
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Synonyms:
cortobenzolone;Cortobenzolone;65849-38-9;DTXSID60984337;9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregna-1,4-dien-21-yl 2-hydroxybenzoate;Pregna-1,4-diene-3,20-dione, 9-fluoro-11,16,17-trihydroxy-21-((2-hydroxybenzoyl)oxy)-, (11beta,16alpha)-
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CAS No:
[2-[(8S,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2-hydroxybenzoate Basic Attributes
514.5 g/mol
514.20029610 g/mol
Computed Properties
Molecular Weight:514.5
XLogP3:3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:514.20029610
Monoisotopic Mass:514.20029610
Topological Polar Surface Area:141
Heavy Atom Count:37
Complexity:1070
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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