(8R,9S,13S,14S,16S,17R)-3-methoxy-13-methyl-16-propyl-7,8,9,11,12,14,15,17-octahydro-6H-cyclopenta[a]phenanthrene-16,17-diol
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![(8R,9S,13S,14S,16S,17R)-3-methoxy-13-methyl-16-propyl-7,8,9,11,12,14,15,17-octahydro-6H-cyclopenta[a]phenanthrene-16,17-diol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/67fab900cc00424094d72dcab995a870.png "(8R,9S,13S,14S,16S,17R)-3-methoxy-13-methyl-16-propyl-7,8,9,11,12,14,15,17-octahydro-6H-cyclopenta[a]phenanthrene-16,17-diol")
(8R,9S,13S,14S,16S,17R)-3-methoxy-13-methyl-16-propyl-7,8,9,11,12,14,15,17-octahydro-6H-cyclopenta[a]phenanthrene-16,17-diol
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CAS No:
7146-94-3
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Formula:
C22H32O3
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Chemical Name:
(8R,9S,13S,14S,16S,17R)-3-methoxy-13-methyl-16-propyl-7,8,9,11,12,14,15,17-octahydro-6H-cyclopenta[a]phenanthrene-16,17-diol
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Synonyms:
16-Propyl-3-methoxy-estra-1,3,5(10)-triene-16beta,17beta-diol;C14934;CHEBI:79459;NSC51843;NSC-51843;7146-94-3;Q27148527;16-Propyl-3-methoxyestra-1,3,5(10)-triene-16beta,17beta-diol
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CAS No:
Description
16-Propyl-3-methoxy-estra-1,3,5(10)-triene-16beta,17beta-diol is a steroid. It derives from a hydride of an estrane.
(8R,9S,13S,14S,16S,17R)-3-methoxy-13-methyl-16-propyl-7,8,9,11,12,14,15,17-octahydro-6H-cyclopenta[a]phenanthrene-16,17-diol Basic Attributes
344.5 g/mol
344.23514488 g/mol
51843
Computed Properties
Molecular Weight:344.5
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:344.23514488
Monoisotopic Mass:344.23514488
Topological Polar Surface Area:49.7
Heavy Atom Count:25
Complexity:494
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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