Formyldienolone
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=1309&show=SHOW-3D Show 3-D Structure] | ||
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structure; RN given refers to (11alpha,17beta)-isomer | structure; RN given refers to (11alpha,17beta)-isomer | ||
==General Properties== | ==General Properties== | ||
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*[http://www.hmdb.ca/metabolites/HMDB04631]Human Metabolome DataBase | *[http://www.hmdb.ca/metabolites/HMDB04631]Human Metabolome DataBase | ||
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Current revision
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Contents |
[edit] Description
structure; RN given refers to (11alpha,17beta)-isomer
[edit] General Properties
*Molecular Weight
344.44
*Molecular Formula
C21H28O4
*IUPAC NAME
(8S,9S,10R,11R,13S,14S,17S)-11,17-dihydroxy-10,13,17-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-2-carbaldehyde
*Canonical Smiles
CC1(CCC2C1(CC(C3C2CCC4=CC(=O)C(=CC34C)C=O)O)C)O
*Isomeric Smiles
C[C@@]1(CC[C@@H]2[C@@]1(C[C@H]([C@H]3[C@H]2CCC4=CC(=O)C(=C[C@]34C)C=O)O)C)O
[edit] PhysioChemical Properties
*Melting Point
1.43(EST)
*LogP
*Water Solubility
