(8S,9S,11S,13S,14S)-17-ethynyl-4,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-11,17-diol
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(8S,9S,11S,13S,14S)-17-ethynyl-4,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-11,17-diol
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CAS No:
17753-11-6
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Formula:
C21H26O2
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Chemical Name:
(8S,9S,11S,13S,14S)-17-ethynyl-4,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-11,17-diol
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Synonyms:
17753-11-6;4-Methyl-19-nor-17alpha-pregna-1,3,5(10)-trien-20-yne-11beta,17-diol;DTXSID40938959;19-Nor-17alpha-pregna-1,3,5(10)-trien-20-yne-11beta,17-diol, 4-methyl-;4,9-Cyclo-9,10-secopregna-1,3,5(10)-trien-20-yne-11,17-diol
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CAS No:
(8S,9S,11S,13S,14S)-17-ethynyl-4,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-11,17-diol Basic Attributes
310.4 g/mol
310.193280068 g/mol
Computed Properties
Molecular Weight:310.4
XLogP3:3.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:310.193280068
Monoisotopic Mass:310.193280068
Topological Polar Surface Area:40.5
Heavy Atom Count:23
Complexity:533
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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