9-Bromo-6ß-fluoro-11ß,17,21-trihydroxypregna-1,4-diene-3,20-dione 17,21-di(acetate) (CHEM089660)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-05 02:18:52 UTC | ||||||||
| Update Date | 2026-04-05 02:18:52 UTC | ||||||||
| Accession Number | CHEM089660 | ||||||||
| Identification | |||||||||
| Common Name | 9-Bromo-6ß-fluoro-11ß,17,21-trihydroxypregna-1,4-diene-3,20-dione 17,21-di(acetate) | ||||||||
| Class | Small Molecule | ||||||||
| Description | 9-Bromo-6ß-fluoro-11ß,17,21-trihydroxypregna-1,4-diene-3,20-dione 17,21-di(acetate) belongs to the pregnane steroids, a subclass of steroids and steroid derivatives within the organic compounds. It is categorized under the superclass of lipids and lipid-like molecules and has the formula C25H30BrFO7. With an average molecular weight of 573.41 g/mol, 9-Bromo-6ß-fluoro-11ß,17,21-trihydroxypregna-1,4-diene-3,20-dione 17,21-di(acetate) is a heavy molecule. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C25H30BrFO7 | ||||||||
| Average Molecular Mass | 573.408 g/mol | ||||||||
| Monoisotopic Mass | 540.116 g/mol | ||||||||
| CAS Registry Number | 60864-40-6 | ||||||||
| IUPAC Name | Not Available | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | [H]C(O)(CC(O)=O)C(=O)C1(CC(O)=O)CC([H])(O)[C@@]2([H])[C@]3([H])C[C@@]([H])(F)C4=CC(=O)C=C[C@]4(C)C3(Br)[C@@]([H])(O)C[C@]12C | ||||||||
| InChI Identifier | InChI=1/C25H30BrFO7/c1-13(28)33-12-21(32)24(34-14(2)29)8-6-16-17-10-19(27)18-9-15(30)5-7-22(18,3)25(17,26)20(31)11-23(16,24)4/h5,7,9,16-17,19-20,31H,6,8,10-12H2,1-4H3 | ||||||||
| InChI Key | KYISBKWLCVBYCW-CYBFZDFUSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
