desoxycorticosterone
21-hydroxy-pregn-4-ene-3,20-dione
 
Notes:
desoxycorticosterone acetate (doca) is used as replacement therapy in addison disease. Deoxycorticosterone is a steroid or mineralocorticoid secreted by the zona fasiculata of the adrenal cortex. Deoxycorticsterone acts as a precursor to aldosterone. Deoxycorticosterone is not a major secretory hormone. It is produced from progesterone by 21beta-hydroxylase and is converted to corticosterone by 11beta-hydroxylase. Corticosterone is then converted to aldosterone by aldosterone synthase. Deoxycorticosterone stimulates the collecting tubules in the kidney to continue to excrete potassium in much the same way that aldosterone does. Deoxycorticosterone has about 1/20 of the sodium retaining power of aldosterone and about 1/5 the potassium excreting power of aldosterone [Wikipedia]. Deoxycorticosterone can be used to treat adrenal insufficiency. In particular, desoxycorticosterone acetate (DOCA) is used as replacement therapy in Addison's disease. [HMDB]
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      Product(s):
      04-06100 DESOXYCORTICOSTERONE
       
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CAS Number: 64-85-7Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 200-596-4
FDA UNII: 40GP35YQ49
Nikkaji Web: J1.407I
Beilstein Number: 2062123
MDL: MFCD00003661
XlogP3: 2.90 (est)
Molecular Weight: 330.46770000
Formula: C21 H30 O3
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome or firefox)
Category: pharmaceuticals / chemical synthisis
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: Search
Google Books: Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Google Patents: Search
US Patents: Search
EU Patents: Search
Pubchem Patents: Search
PubMed: Search
NCBI: Search
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Melting Point: 141.50 °C. @ 760.00 mm Hg
Boiling Point: 488.02 °C. @ 760.00 mm Hg (est)
Flash Point: 505.00 °F. TCC ( 263.10 °C. ) (est)
logP (o/w): 2.880
Soluble in:
 water, 59.5 mg/L @ 37 °C (exp)
 water, 91.16 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Penta International
DESOXYCORTICOSTERONE
Santa Cruz Biotechnology
For experimental / research use only.
21-Hydroxyprogesterone
Sigma-Aldrich: Sigma
For experimental / research use only.
21-Hydroxyprogesterone ≥97% (HPLC)
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Safety Information:
Preferred SDS: View
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
unreported-mouse LD50  1000 mg/kg
Journal of Medicinal Chemistry. Vol. 7, Pg. 673, 1964.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: pharmaceuticals / chemical synthisis
Recommendation for desoxycorticosterone usage levels up to:
 not for fragrance use.
 
Recommendation for desoxycorticosterone flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
Daily Med: search
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 6166
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 (8S,9S,10R,13S,14S,17S)-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Chemidplus: 0000064857
RTECS: HG0350000 for cas# 64-85-7
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References:
 (8S,9S,10R,13S,14S,17S)-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 6166
Pubchem (sid): 134972466
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Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
CHEBI: View
CHEMBL: View
Golm Metabolome Database: Search
Metabolomics Database: Search
KEGG (GenomeNet): C03205
HMDB (The Human Metabolome Database): HMDB00016
FooDB: FDB021873
Export Tariff Code: 2937.29.0050
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
Wikipedia: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 found in nature
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Synonyms:
 cortexone
 corticosterone, 11-deoxy-
11-dehydroxycorticosterone
11-deoxy-corticosterone
1,2(3H)-deoxycorticosterone
11-deoxycorticosterone
 desossicortone
 desoxicortonum
11-desoxycorticosterone
 desoxycorticosteronum
 desoxycortonum
 dorcostrin
21-hydroxy-3,20-dioxopregn-4-ene
21-hydroxy-D4-pregnane-3,20-dione
21-hydroxy-pregn-4-ene-3,20-dione
21-hydroxy-progesterone
(8S,9S,10R,13S,14S,17S)-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
21-hydroxypregn-4-ene-3,20-dione
 kendall's desoxy compound B
 pregn-4-ene-3,20-dione, 21-hydroxy-
D4-pregnene-21-ol-3,20-dione
 progesterone, 21-hydroxy-
 reichstein Q
 reichstein's substance Q
 undocan
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