[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-16-(2,2,2-trifluoroethyl)-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
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[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-16-(2,2,2-trifluoroethyl)-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
structure -
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CAS No:
2194-21-0
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Formula:
C23H33F3O3
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Chemical Name:
[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-16-(2,2,2-trifluoroethyl)-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
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Synonyms:
2194-21-0;NSC45235;DTXSID40944535;NSC-45235;17-Oxo-16-(2,2,2-trifluoroethyl)androstan-3-yl acetate
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CAS No:
[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-16-(2,2,2-trifluoroethyl)-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate Basic Attributes
414.5 g/mol
414.23817940 g/mol
45235
Computed Properties
Molecular Weight:414.5
XLogP3:5.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:414.23817940
Monoisotopic Mass:414.23817940
Topological Polar Surface Area:43.4
Heavy Atom Count:29
Complexity:689
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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