(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3-dione
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![(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/375f5400ca784b8d875725a5313f93fe.png "(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3-dione")
(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3-dione
structure -
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CAS No:
42261-16-5
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Formula:
C18H22O3
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Chemical Name:
(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3-dione
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Synonyms:
estradiol-2,3-O-quinone;estradiol-2,3-quinone;42261-16-5;Estradiol-2,3-quinone;Estradiol-2,3-O-quinone;DTXSID90962401;(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3-dione;17-Hydroxyestra-1(10),4-diene-2,3-dione;17beta-Hydroxy-1(10),4-estradiene-2,3-dione;Estra-1(10),4-diene-2,3-dione, 17-hydroxy-, (17beta)-
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CAS No:
(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3-dione Basic Attributes
286.4 g/mol
286.15689456 g/mol
Computed Properties
Molecular Weight:286.4
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:286.15689456
Monoisotopic Mass:286.15689456
Topological Polar Surface Area:54.4
Heavy Atom Count:21
Complexity:585
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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