Desoxycorticosterone acetate

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==Description==
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[http://crdd.osdd.net/raghava/hmrbase/test_extract.php?db=arun&table=nphormonet&id=1040&show=SHOW-3D Show 3-D Structure]
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{{Drugbox
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| IUPAC_name        = [2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
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| CAS_number        =
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| ATC_suffix =
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| ATC_supplemental  =
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| PubChem          = 5952
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| ChemSpiderID      =
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| chemical_formula  =C<sub>2</sub><sub>3</sub>H<sub>3</sub><sub>2</sub>O<sub>4</sub>
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| molecular_weight  = 372.5
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| smiles            = CC(=O)OCC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C
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| synonyms          = Decosteron
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| density          =
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| melting_point    = 157(EXP)
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| boiling_point    =
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| solubility        = 8.73(EXP) at 25<sup>o</sup>C
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| specific_rotation =
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21-Hydroxypregn-4-ene-3,20-dione. Desoxycorticosterone acetate (DOCA)  is used as replacement therapy in ADDISON DISEASE.
21-Hydroxypregn-4-ene-3,20-dione. Desoxycorticosterone acetate (DOCA)  is used as replacement therapy in ADDISON DISEASE.
==General Properties==
==General Properties==
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[[Categories:Hormones]]
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[[Category:Hormones]]

Current revision

Show 3-D Structure

Desoxycorticosterone acetate
Systematic (IUPAC) name
[2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Identifiers
CAS number  ?
ATC code  ?
PubChem 5952
Chemical data
Formula C23H32O4
Mol. mass 372.5
SMILES eMolecules & PubChem
Synonyms Decosteron
Physical data
Melt. point 157(EXP) °C
Solubility in water 8.73(EXP) at 25oC mg/mL
Pharmacokinetic data
Bioavailability  ?
Metabolism  ?
Half life  ?
Excretion  ?
Therapeutic considerations
Pregnancy cat.

?

Legal status
Routes  ?

21-Hydroxypregn-4-ene-3,20-dione. Desoxycorticosterone acetate (DOCA) is used as replacement therapy in ADDISON DISEASE.

[edit] General Properties

*Molecular Weight

372.5

*Molecular Formula

C23H32O4

*IUPAC NAME

[2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate

*Canonical Smiles

CC(=O)OCC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C

*Isomeric Smiles

CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C


[edit] PhysioChemical Properties

*Melting Point

157(EXP)

*LogP

3.08(EXP)

*Water Solubility

8.73(EXP) at 25C

[edit] External Links