5,6-dihydroxyhexyl [(8R,9S,10R,14S)-13-ethyl-17-ethynyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] carbonate
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5,6-dihydroxyhexyl [(8R,9S,10R,14S)-13-ethyl-17-ethynyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] carbonate
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CAS No:
117635-13-9
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Formula:
C28H40O6
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Chemical Name:
5,6-dihydroxyhexyl [(8R,9S,10R,14S)-13-ethyl-17-ethynyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] carbonate
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Synonyms:
Levonorgestrel hexanediol;117635-13-9;18,19-Dinorpregn-4-en-20-yn-3-one, 17-((((5,6-dihydroxyhexyl)oxy)carbonyl)oxy)-13-ethyl-, (17alpha)-
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CAS No:
5,6-dihydroxyhexyl [(8R,9S,10R,14S)-13-ethyl-17-ethynyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] carbonate Basic Attributes
472.6 g/mol
472.28248899 g/mol
Computed Properties
Molecular Weight:472.6
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:11
Exact Mass:472.28248899
Monoisotopic Mass:472.28248899
Topological Polar Surface Area:93.1
Heavy Atom Count:34
Complexity:854
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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