Pregnane-3,20-dione, (5b) structure
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Common Name | Pregnane-3,20-dione, (5b) | ||
|---|---|---|---|---|
| CAS Number | 128-23-4 | Molecular Weight | 316.47800 | |
| Density | 1.048g/cm3 | Boiling Point | 429.2ºC at 760mmHg | |
| Molecular Formula | C21H32O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 160.3ºC | |
| Name | 5β-pregnane-3,20-dione |
|---|---|
| Synonym | More Synonyms |
| Density | 1.048g/cm3 |
|---|---|
| Boiling Point | 429.2ºC at 760mmHg |
| Molecular Formula | C21H32O2 |
| Molecular Weight | 316.47800 |
| Flash Point | 160.3ºC |
| Exact Mass | 316.24000 |
| PSA | 34.14000 |
| LogP | 4.80340 |
| Vapour Pressure | 1.43E-07mmHg at 25°C |
| Index of Refraction | 1.515 |
| InChIKey | XMRPGKVKISIQBV-XWOJZHJZSA-N |
| SMILES | CC(=O)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C |
| Storage condition | -20°C |
| Precursor 9 | |
|---|---|
| DownStream 6 | |
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Name: Human Pregnane X receptor (1I. Vitamin D receptor-like receptors)
Source: IUPHAR-DB
Target: Pregnane X receptor (1I. Vitamin D receptor-like receptors) [Homo sapiens]
External Id: 606_Human
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Name: Increase in human nuclear co-repressor receptor binding to human CAR-LBD expressed in...
Source: ChEMBL
Target: Nuclear receptor subfamily 1 group I member 3
External Id: CHEMBL948402
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Name: Activation of human CAR-LBD expressed in human C3A cells at 10 uM after 24 hrs by GAL...
Source: ChEMBL
Target: Nuclear receptor subfamily 1 group I member 3
External Id: CHEMBL941272
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Name: TP_TRANSPORTER: Northern blot from LS174T cell
Source: ChEMBL
Target: ATP-dependent translocase ABCB1
External Id: CHEMBL2076254
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Name: Increase in human steroid receptor coactivator 1 binding to human CAR-LBD expressed i...
Source: ChEMBL
Target: Nuclear receptor subfamily 1 group I member 3
External Id: CHEMBL948401
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Name: Inhibition of p-gp (unknown origin) in doxorubicin-resistant human K562/R7 cells asse...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3420915
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Name: Relative binding affinity to human progesterone receptor
Source: ChEMBL
Target: Progesterone receptor
External Id: CHEMBL3281642
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Name: Inhibition of mouse constitutive androstane receptor (mCAR) activity at 10 uM was det...
Source: ChEMBL
Target: Nuclear receptor subfamily 1 group I member 3
External Id: CHEMBL666775
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Name: Relative binding affinity to rabbit progesterone receptor
Source: ChEMBL
Target: Progesterone receptor
External Id: CHEMBL3281644
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Name: Relative binding affinity to sheep progesterone receptor
Source: ChEMBL
Target: Progesterone receptor
External Id: CHEMBL3281643
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| 5beta-Pregnan-3,20-dione |
| (5R,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 |
| 3,20-Pregnanedione |
| 5beta-Dihydroprogesterone |
| 5beta-pregnane-3,20-dione |
| CI2 |
| 5b-pregnane-3,20-dione |