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Exemestane
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$54.99$59.99
- Concentration
- 25 mg per mL
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$54.99$59.99
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| Molecular Formula | C20H24O2 |
| Molecular Weight | 296.4 |
| Monoisotopic Mass | 296.177630004 |
| Polar Area | 34.1 |
| Complexity | 653 |
| XLogP | 3.1 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Physical Appearance | Clear Liquid |
| Stability | Room Temperature |
| PubChem LCSS | Exemestane Laboratory Chemical Safety Summary |
| Property | Property Value |
|---|---|
| CID | 60198 |
| CAS | 107868-30-4 |
| InChI | InChI=1S/C20H24O2/c1-12-10-14-15-4-5-18(22)20(15, 3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h6, 8, 11, 14-16H, 1, 4-5, 7, 9-10H2, 2-3H3/t14-, 15-, 16-, 19+, 20-/m0/s1 |
| InChIKey | BFYIZQONLCFLEV-DAELLWKTSA-N |
| Isomeric SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC(=C)C4=CC(=O)C=C[C@]34C |
| Canonical SMILES | CC12CCC3C(C1CCC2=O)CC(=C)C4=CC(=O)C=CC34C |
| IUPAC Name | (8R, 9S, 10R, 13S, 14S)-10, 13-dimethyl-6-methylidene-7, 8, 9, 11, 12, 14, 15, 16-octahydrocyclopenta[a]phenanthrene-3, 17-dione |
Generated by Extreme Peptide with Open Babel, version 2.3.1, http://openbabel.org (accessed June 28, 2022)
Interactive 3D representation of Exemestane (CID 60198)
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