Bioactive Compound Details
| BioID | bio200404 |
|---|---|
| Name | OSATERONE ACETATE |
| ChEMBL ID | CHEMBL5315059 |
| Molecular Formula | C22H27ClO5 |
| Molecular Weight | 406.91 |
| Molecular Weight (Monoisotopic) | 406.1547 |
| Type | Small molecule |
| Max Phase | Unknown |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-OXOCHLORMADINONE ACETATE|OSATERONE ACETATE|OSATERONE ACETATE ESTER|TZP-4238|Ypozane |
| Smiles | CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)OC[C@]4(C)[C@H]3CC[C@@]21C |
| Inchi | InChI=1S/C22H27ClO5/c1-12(24)22(28-13(2)25)8-6-16-14-9-18(23)17-10-19(26)27-11-20(17,3)15(14)5-7-21(16,22)4/h9-10,14-16H,5-8,11H2,1-4H3/t14-,15+,16+,20-,21+,22+/m1/s1 |
| Inchi Key | KKTIOMQDFOYCEN-OFUYBIASSA-N |
| Molecular Species | NEUTRAL |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | 1.91 |
| Records Key | ['OSATERONE ACETATE'] |
| Records Name | ['OSATERONE ACETATE'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
