Prednicarbate
From DrugPedia: A Wikipedia for Drug discovery
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==Description== | ==Description== | ||
+ | [http://172.141.127.22/raghava/hmrbase/test_extract.php?db=arun&table=nphormonet&id=1102&show=SHOW-3D Show 3-D Structure] | ||
==General Properties== | ==General Properties== | ||
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*[http://www.drugbank.ca/drugs/DB01130]Drugbank | *[http://www.drugbank.ca/drugs/DB01130]Drugbank | ||
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Current revision
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Contents |
[edit] Description
[edit] General Properties
*Molecular Weight
488.57
*Molecular Formula
C27H36O8
*IUPAC NAME
[2-[(8S,9S,10R,11S,13S,14S,17R)-17-ethoxycarbonyloxy-11-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate
*Canonical Smiles
CCC(=O)OCC(=O)C1(CCC2C1(CC(C3C2CCC4=CC(=O)C=CC34C)O)C)OC(=O)OCC
*Isomeric Smiles
CCC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)O)C)OC(=O)OCC
[edit] PhysioChemical Properties
*Melting Point
*LogP
*Water Solubility