16alpha-Hydroxyestrone
From DrugPedia: A Wikipedia for Drug discovery
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==Description== | ==Description== | ||
+ | [http://crdd.osdd.net/raghava/hmrbase/test_extract.php?&db=arun&table=nphormonet&id=1221&show=SHOW-3D Show 3-D Structure] | ||
==General Properties== | ==General Properties== |
Revision as of 12:04, 19 February 2009
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Contents |
Description
General Properties
*Molecular Weight
286.37
*Molecular Formula
C18H22O3
*IUPAC NAME
(8S,9R,13S,14R,16R)-3,16-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
*Canonical Smiles
CC12CCC3C(C1CC(C2=O)O)CCC4=C3C=CC(=C4)O
*Isomeric Smiles
C[C@]12CC[C@@H]3[C@@H]([C@H]1C[C@H](C2=O)O)CCC4=C3C=CC(=C4)O
PhysioChemical Properties
*Melting Point
*LogP
*Water Solubility