[(8S,9S,10R,11S,13S,14S,17R)-17-(2-acetyloxyacetyl)-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-11-yl] 2,2,2-trifluoroacetate
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[(8S,9S,10R,11S,13S,14S,17R)-17-(2-acetyloxyacetyl)-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-11-yl] 2,2,2-trifluoroacetate
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CAS No:
565-83-3
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Formula:
C25H31F3O7
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Chemical Name:
[(8S,9S,10R,11S,13S,14S,17R)-17-(2-acetyloxyacetyl)-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-11-yl] 2,2,2-trifluoroacetate
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Synonyms:
NSC75562;(11|A)-21-(acetyloxy)-17-hydroxy-3,20-dioxopregn-4-en-11-yl trifluoroacetate;63468-41-7;SCHEMBL11125058;DTXSID10291442;ZINC4887120;NSC-75562;[(8S,9S,10R,11S,13S,14S,17R)-17-(2-acetyloxyacetyl)-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-11-yl] 2,2,2-trifluoroacetate;565-83-3
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CAS No:
[(8S,9S,10R,11S,13S,14S,17R)-17-(2-acetyloxyacetyl)-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-11-yl] 2,2,2-trifluoroacetate Basic Attributes
500.5 g/mol
500.20218781 g/mol
75562
DTXSID10291442
Computed Properties
Molecular Weight:500.5
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:500.20218781
Monoisotopic Mass:500.20218781
Topological Polar Surface Area:107
Heavy Atom Count:35
Complexity:988
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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