(8S,9S,11R,13S,14S)-3-cyclopentyloxy-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-11,17-diol
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(8S,9S,11R,13S,14S)-3-cyclopentyloxy-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-11,17-diol
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CAS No:
111102-94-4
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Formula:
C25H32O3
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Chemical Name:
(8S,9S,11R,13S,14S)-3-cyclopentyloxy-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-11,17-diol
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Synonyms:
11 alpha-hydroxyquinestrol;111102-94-4;11alpha-Hydroxyquinestrol;DTXSID40911989;3-(Cyclopentyloxy)-19-norpregna-1(10),2,4-trien-20-yne-11,17-diol
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CAS No:
(8S,9S,11R,13S,14S)-3-cyclopentyloxy-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-11,17-diol Basic Attributes
380.5 g/mol
380.23514488 g/mol
Computed Properties
Molecular Weight:380.5
XLogP3:4.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:380.23514488
Monoisotopic Mass:380.23514488
Topological Polar Surface Area:49.7
Heavy Atom Count:28
Complexity:645
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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