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Basic Description
| Synonyms | AS-14686 | BCP16136 | Chlormadinonum | Pregna-4,6-diene-3,20-dione, 6-chloro-17-hydroxy- | UNII-SDS4N642GG | SMR004701479 | Q905012 | 6-CHLORO-6-DEHYDRO-17.ALPHA.-HYROXYPROGESTERONE | MLS006010797 | Clormadinona [INN-Spanish] | Clormadinona | Clormadinone |
|---|---|
| Specifications & Purity | ≥98% |
| Storage Temp | Store at -20°C |
| Shipped In |
Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available. |
| Product Description |
Chlormadinone is a compound used in reproductive research.
Chlormadinone is an antiandrogen drug. Chlormadinone combined with Tamsulosin shows greater improvement in subjective symptoms of BPH
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Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
- Subclass Pregnane steroids
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Class
Steroids and steroid derivatives
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Superclass
Lipids and lipid-like molecules
| Kingdom | Organic compounds |
|---|---|
| Superclass | Lipids and lipid-like molecules |
| Class | Steroids and steroid derivatives |
| Subclass | Pregnane steroids |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Gluco/mineralocorticoids, progestogins and derivatives |
| Alternative Parents | 20-oxosteroids Halogenated steroids 3-oxosteroids 17-hydroxysteroids Cyclohexenones Tertiary alcohols Alpha-hydroxy ketones Cyclic alcohols and derivatives Vinyl chlorides Chloroalkenes Organochlorides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic homopolycyclic compounds |
| Substituents | Progestogin-skeleton - 20-oxosteroid - 3-oxosteroid - 6-halo-steroid - Halo-steroid - Hydroxysteroid - Oxosteroid - 17-hydroxysteroid - Cyclohexenone - Cyclic alcohol - Tertiary alcohol - Alpha-hydroxy ketone - Cyclic ketone - Ketone - Vinyl chloride - Vinyl halide - Haloalkene - Chloroalkene - Organochloride - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Alcohol - Organic oxygen compound - Organooxygen compound - Organic oxide - Aliphatic homopolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as gluco/mineralocorticoids, progestogins and derivatives. These are steroids with a structure based on a hydroxylated prostane moiety. |
| External Descriptors | Not available |
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Product Properties
| pKa | pKa: 12.87 (Predicted) |
|---|
Associated Targets(non-human)
Rattus norvegicus (775804 Activities)
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
Mechanisms of Action
| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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Names and Identifiers
| IUPAC Name | (8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-17-hydroxy-10,13-dimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one |
|---|---|
| INCHI | InChI=1S/C21H27ClO3/c1-12(23)21(25)9-6-16-14-11-18(22)17-10-13(24)4-7-19(17,2)15(14)5-8-20(16,21)3/h10-11,14-16,25H,4-9H2,1-3H3/t14-,15+,16+,19-,20+,21+/m1/s1 |
| InChIKey | VUHJZBBCZGVNDZ-TTYLFXKOSA-N |
| Smiles | CC(=O)C1(CCC2C1(CCC3C2C=C(C4=CC(=O)CCC34C)Cl)C)O |
| Isomeric SMILES | CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C=C(C4=CC(=O)CC[C@]34C)Cl)C)O |
| Molecular Weight | 362.89 |
| Reaxy-Rn | 37825928 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=37825928&ln= |
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 J2417478 |
Certificate of Analysis | Sep 12, 2024 | C346107 |
| J2417474 |
Certificate of Analysis | Sep 12, 2024 | C346107 |
| J2417473 |
Certificate of Analysis | Sep 12, 2024 | C346107 |
| J2417479 |
Certificate of Analysis | Sep 12, 2024 | C346107 |
| J2417480 |
Certificate of Analysis | Sep 12, 2024 | C346107 |
| J2417486 |
Certificate of Analysis | Sep 12, 2024 | C346107 |
| J2417489 |
Certificate of Analysis | Sep 12, 2024 | C346107 |
| J2417499 |
Certificate of Analysis | Sep 12, 2024 | C346107 |
Chemical and Physical Properties
| Solubility | Soluble in methanol, chloroform, and dioxane. |
|---|---|
| Refractive Index | n20D1.58 (Predicted) |
| Boil Point(°C) | ~506.7° C at 760 mmHg (Predicted) |
| Melt Point(°C) | 196-199° C (dec.) |
| Molecular Weight | 362.900 g/mol |
| XLogP3 | 3.000 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 362.165 Da |
| Monoisotopic Mass | 362.165 Da |
| Topological Polar Surface Area | 54.400 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 723.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 6 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
Solution Calculators
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