(8R,9S,13S,14S,16S,17R)-3-methoxy-13,16-dimethyl-4,6,7,8,9,11,12,14,15,17-decahydro-1H-cyclopenta[a]phenanthrene-16,17-diol
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![(8R,9S,13S,14S,16S,17R)-3-methoxy-13,16-dimethyl-4,6,7,8,9,11,12,14,15,17-decahydro-1H-cyclopenta[a]phenanthrene-16,17-diol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9b3972c7a48040348651a0c22ac7cc46.png "(8R,9S,13S,14S,16S,17R)-3-methoxy-13,16-dimethyl-4,6,7,8,9,11,12,14,15,17-decahydro-1H-cyclopenta[a]phenanthrene-16,17-diol")
(8R,9S,13S,14S,16S,17R)-3-methoxy-13,16-dimethyl-4,6,7,8,9,11,12,14,15,17-decahydro-1H-cyclopenta[a]phenanthrene-16,17-diol
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CAS No:
6968-86-1
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Formula:
C20H30O3
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Chemical Name:
(8R,9S,13S,14S,16S,17R)-3-methoxy-13,16-dimethyl-4,6,7,8,9,11,12,14,15,17-decahydro-1H-cyclopenta[a]phenanthrene-16,17-diol
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Synonyms:
3-Methoxy-16-methyl-estra-2,5(10)-diene-16beta,17beta-diol;C14945;CHEBI:79469;NSC66590;ZINC4758554;NSC-66590;Q27148543;3-Methoxy-16-methylestra-2,5(10)-diene-16beta,17beta-diol;6968-86-1
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CAS No:
(8R,9S,13S,14S,16S,17R)-3-methoxy-13,16-dimethyl-4,6,7,8,9,11,12,14,15,17-decahydro-1H-cyclopenta[a]phenanthrene-16,17-diol Basic Attributes
318.4 g/mol
318.21949481 g/mol
66590
Computed Properties
Molecular Weight:318.4
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:318.21949481
Monoisotopic Mass:318.21949481
Topological Polar Surface Area:49.7
Heavy Atom Count:23
Complexity:577
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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