Introduction：Basic information about CORTEXOLONE CAS 152-58-9, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
CORTEXOLONE Basic information
| Product Name: | CORTEXOLONE |
| Synonyms: | (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one;Hydrocortisone Impurity 6（Hydrocortisone EP Impurity F）;11-DEOXYCORTISOL; CORTEXOLONE; REICHSTEIN'S SUBSTANCE S;11-dioxy-cortiso;11-dioxycortisol;17,21-dihydroxy-pregn-4-ene-20-dione;17-hydroxy-11-deoxycorticosterone;nsc-18317 |
| CAS: | 152-58-9 |
| MF: | C21H30O4 |
| MW: | 346.46 |
| EINECS: | 205-805-2 |
| Product Categories: | Inhibitors;Intermediates & Fine Chemicals;Pharmaceuticals;Steroids;Biochemistry;Hydroxyketosteroids;Pharmaceutical Raw Materials;152-58-9;1 |
| Mol File: | 152-58-9.mol |
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CORTEXOLONE Chemical Properties
| Melting point | 205-208 °C |
| Boiling point | 401.19°C (rough estimate) |
| density | 1.22±0.1 g/cm3 (20 ºC 760 Torr) |
| refractive index | 120 ° (C=1, Dioxane) |
| Fp | 9℃ |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Dioxane (Slightly, Heated, Sonicated), DMSO (Slightly), Methanol (Slightly, Heated) |
| pka | 12?+-.0.60(Predicted) |
| form | Solid |
| color | White to Off-White |
| Water Solubility | 44.08mg/L(37 ºC) |
| Merck | 14,2932 |
| Major Application | diagnostic assay manufacturing
hematology
histology |
| InChI | InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15-,16+,17+,19+,20+,21+/m1/s1 |
| InChIKey | WHBHBVVOGNECLV-OBQKJFGGSA-N |
| SMILES | C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@](O)(C(=O)CO)CC3)CC2 |
| CAS DataBase Reference | 152-58-9(CAS DataBase Reference) |
Safety Information
| Hazard Codes | F,T |
| Risk Statements | 11-23/24/25-39/23/24/25 |
| Safety Statements | 24/25-22-45-36/37-16-7 |
| RIDADR | UN1230 - class 3 - PG 2 - Methanol, solution |
| WGK Germany | 3 |
| RTECS | TU5011500 |
| HS Code | 2937.23.5050 |
| Storage Class | 11 - Combustible Solids |
| Toxicity | mouse,LD50,intravenous,100mg/kg (100mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04684, |
CORTEXOLONE Usage And Synthesis
| Chemical Properties | Crystalline Solid |
| Uses | 11-Deoxy Cortisol (Hydrocortisone EP Impurity F) is a glucocorticoid receptor binding. |
| Definition | ChEBI: 11-deoxycortisol is a deoxycortisol that is cortisol in which the hydroxy group at position 11 has been replaced by a hydrogen. It has a role as a mouse metabolite and a human metabolite. It is a glucocorticoid, a primary alpha-hydroxy ketone, a tertiary alpha-hydroxy ketone and a deoxycortisol. |
| in vivo | Cortodoxone (100 mg/kg; i.p.) increases tryptophan oxygenase (TO) activity and induces the secretion of corticosterone[1]. | Animal Model: | 220-320g, adult male Wistar rats[2] | | Dosage: | 100 mg/kg | | Administration: | IP | | Result: | Increased tryptophan oxygenase (TO) activity and induced the secretion of corticosterone. |
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| IC 50 | Human Endogenous Metabolite |
CORTEXOLONE Preparation Products And Raw materials
| Preparation Products | 17,20:20,21-Bis(Methylenedioxy)pregn-4-en-3-one |
