Introduction:Basic information about CAS 566-65-4|5α-Dihydroprogesterone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 5α-Dihydroprogesterone |
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| CAS Number | 566-65-4 | Molecular Weight | 316.478 |
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| Density | 1.0±0.1 g/cm3 | Boiling Point | 429.2±38.0 °C at 760 mmHg |
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| Molecular Formula | C21H32O2 | Melting Point | 204 °C |
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| MSDS | / | Flash Point | 160.3±23.8 °C |
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Names
| Name | 5α-pregnane-3,20-dione |
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| Synonym | More Synonyms |
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5α-Dihydroprogesterone BiologicalActivity
| Description | 5a-Pregnane-3,20-dione is the endogenous progesterone metabolite. |
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| Related Catalog | Research Areas >>EndocrinologyNatural Products >>Flavonoids |
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| Target | Human Endogenous Metabolite |
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| In Vitro | 5a-Pregnane-3,20-dione decreases cell-substrate attachment, adhesion plaques, vinculin expression, and polymerizes F-actin in MCF-7 breast cancer cells[1]. |
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| References | [1]. Wiebe JP, et al. The endogenous progesterone metabolite, 5a-pregnane-3,20-dione, decreases cell-substrate attachment, adhesion plaques, vinculin expression, and polymerized F-actin in MCF-7 breast cancer cells. Endocrine. 2001 Oct;16(1):7-14. |
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Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
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| Boiling Point | 429.2±38.0 °C at 760 mmHg |
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| Melting Point | 204 °C |
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| Molecular Formula | C21H32O2 |
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| Molecular Weight | 316.478 |
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| Flash Point | 160.3±23.8 °C |
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| Exact Mass | 316.240234 |
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| PSA | 34.14000 |
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| LogP | 4.31 |
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| Vapour Pressure | 0.0±1.0 mmHg at 25°C |
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| Index of Refraction | 1.516 |
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| InChIKey | XMRPGKVKISIQBV-BJMCWZGWSA-N |
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| SMILES | CC(=O)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- TU4157150
- CHEMICAL NAME :
- 5-beta-Pregnane-3,20-dione
- CAS REGISTRY NUMBER :
- 566-65-4
- BEILSTEIN REFERENCE NO. :
- 2058506
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C21-H32-O2
- MOLECULAR WEIGHT :
- 316.53
- WISWESSER LINE NOTATION :
- L E5 B666 OVTJ A1 E1 FV1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 80 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,117,1968
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 10 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,117,1968
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Safety Information
| Hazard Codes | Xi |
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| WGK Germany | 3 |
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| RTECS | TU4157150 |
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Synonyms
| 5a-Dihydroprogesterone |
| 4-07-00-02199 (Beilstein Handbook Reference) |
| Pregnane-3,20-dione, (5-α)- (9CI) |
| 5alpha-Pregnan-3,20-dione |
| MFCD00067132 |
| Allopregnane-3,20-dione |
| (5S,8R,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one |
| UNII:98G4S1OH0Z |
| 5α-pregnane-3,20-dione |
| (5α)-Pregnane-3,20-dione |
| Pregnane-3,20-dione |
| 5α-dihydroprogesterone |
| EINECS 209-297-3 |
| Allopregnan-3,20-dione |
| 3,20-Allopregnanedione |
| 5alpha-pregnane-3,20-dione |
| 3,20-Dioxo-5a-pregnane |
| 5a-Pregnan-3,20-dione |
| Pregnane-3,20-dione, (5α)- |
| Pregnane-3,20-dione, (5α)- (9CI) |
| 3,20-Dioxo-5alpha-pregnane |
| 5-α-pregnane-3,20-dione |
| allopregnandione |
| 5alpha-Dihydroprogesterone |
| 5a-Pregnane-3,20-dione |
| 5α-Pregnane-3,20-dione (8CI) |
| (5Alpha)-Pregnane-3,20-dione |