[(7R,13S)-1-acetyl-17-ethynyl-17-hydroxy-7,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] acetate
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[(7R,13S)-1-acetyl-17-ethynyl-17-hydroxy-7,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] acetate
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CAS No:
74178-54-4
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Formula:
C25H30O4
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Chemical Name:
[(7R,13S)-1-acetyl-17-ethynyl-17-hydroxy-7,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] acetate
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Synonyms:
1,3-diacetyl-17 alpha-ethinyl-7 alpha-methyl-1,3,5(10)estratriene-17,3-ol;DAEMET-17,3-OL;74178-54-4;Daemet-17,3-OL;DTXSID00995649;1,3-Diacetyl-17alpha-ethinyl-7alpha-methyl-1,3,5(10)estratriene-17,3-ol;1-Acetyl-17-hydroxy-7-methyl-19-norpregna-1(10),2,4-trien-20-yn-3-yl acetate;Ethanone, 1-((7alpha,17alpha)-3-(acetyloxy)-17-hydroxy-7-methyl-19-norpregna-1,3,5(10)-trien-20-yn-1-yl)-
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CAS No:
[(7R,13S)-1-acetyl-17-ethynyl-17-hydroxy-7,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] acetate Basic Attributes
394.5 g/mol
394.21440943 g/mol
Computed Properties
Molecular Weight:394.5
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:394.21440943
Monoisotopic Mass:394.21440943
Topological Polar Surface Area:63.6
Heavy Atom Count:29
Complexity:749
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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