Plomestane
(8R,9S,10S,13S,14S)-13-methyl-10-prop-2-ynyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
Also Known As: Plomestane|Plomestano|plomestanum|Plomestane [USAN:INN]|PLOMESTANE [INN]|Plomestane (USAN/INN)|PLOMESTANE [USAN]|2,4-Dibromobenzyl alcohol|10-Propargylandrostenedione|10-PED|MDL 18,962|19-acetylenic androstenedione|10-(2-Propynyl)estr-4-ene-3,17-dione|10-propargylestr-4-ene-3,17-dione|MDL 18962|Estr-4-ene-3,17-dione, 10-(2-propynyl)-|MDL-18,962|10-propargylandrost-4-ene-3,17-dione|10beta-propargyl-estra-4-ene-3,17-dione|10-(2-propynyl)-estr-4-ene-3,17-dione|10-(2-PROPYNL)-ESTR-4-ENE-3,17-DIONE|(8R,9S,10S,13S,14S)-13-methyl-10-prop-2-ynyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione|(3aS,3bR,9aS,9bS,11aS)-11a-methyl-9a-(prop-2-yn-1-yl)-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-dione|(3aS,3bR,9aS,9bS,11aS)-11a-Methyl-9a-(prop-2-yn-1-yl)-2,3,3a,4,5,8,9,9a,9b,10,11,11a-dodecahydro-1H-cyclopenta[a]phenanthrene-1,7(3bH)-dione
| Molecular Formula | C21H26O2 |
|---|---|
| Molecular Weight | 310.19327 g/mol |
| LogP | 4.0908 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 310.19327 |
| Monoisotopic Mass | 310.19327 |
| Heavy Atoms | 23 |
| Complexity | 636.7172 |
Chemical Identifiers
| CAS Number | 77016-85-4 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)CC[C@]34CC#C |
Product Overview
Plomestane (CAS 77016-85-4), with molecular formula C21H26O2 and molecular weight 310.19327 g/mol. IUPAC: (8R,9S,10S,13S,14S)-13-methyl-10-prop-2-ynyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione.
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