Calusterone
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=1341&show=SHOW-3D Show 3-D Structure] | ||
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was MH 1975-92 (see under METHYLTESTOSTERONE 1975-90); use METHYLTESTOSTERONE to search CALUSTERONE 1975-92; RN given refers to the (7beta,17beta)-isomer | was MH 1975-92 (see under METHYLTESTOSTERONE 1975-90); use METHYLTESTOSTERONE to search CALUSTERONE 1975-92; RN given refers to the (7beta,17beta)-isomer | ||
==General Properties== | ==General Properties== | ||
Revision as of 14:38, 19 February 2009
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Contents |
Description
was MH 1975-92 (see under METHYLTESTOSTERONE 1975-90); use METHYLTESTOSTERONE to search CALUSTERONE 1975-92; RN given refers to the (7beta,17beta)-isomer
General Properties
*Molecular Weight
316.48
*Molecular Formula
C21H32O2
*IUPAC NAME
(7S,8R,9S,10R,13S,14S,17S)-17-hydroxy-7,10,13,17-tetramethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
*Canonical Smiles
CC1CC2=CC(=O)CCC2(C3C1C4CCC(C4(CC3)C)(C)O)C
*Isomeric Smiles
C[C@H]1CC2=CC(=O)CC[C@@]2([C@@H]3[C@@H]1[C@@H]4CC[C@]([C@]4(CC3)C)(C)O)C
PhysioChemical Properties
*Melting Point
*LogP
*Water Solubility
