2-Hydroxymethylene Ethisterone
(8R,9S,10R,13S,14S,17R)-17-ethynyl-17-hydroxy-2-(hydroxymethylidene)-10,13-dimethyl-1,6,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: 2-Hydroxymethylene Ethisterone|EINECS 220-513-5|EC 220-513-5|17alpha-Hydroxy-2-(hydroxymethylene)pregn-4-en-20-yn-3-one
| Molecular Formula | C22H28O3 |
|---|---|
| Molecular Weight | 340.20386 g/mol |
| LogP | 3.93 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 340.20386 |
| Heavy Atoms | 25 |
| Complexity | 726.0 |
Chemical Identifiers
| CAS Number | 2787-02-2 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=O)C(=CO)C[C@]34C |
Product Overview
2-Hydroxymethylene Ethisterone (CAS 2787-02-2), with molecular formula C22H28O3 and molecular weight 340.20386 g/mol. IUPAC: (8R,9S,10R,13S,14S,17R)-17-ethynyl-17-hydroxy-2-(hydroxymethylidene)-10,13-dimethyl-1,6,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one.
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