17-Hydroxy-10-mercaptoestr-4-en-3-one
(8S,9S,13S,14S,17S)-17-hydroxy-13-methyl-10-sulfanyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Also Known As: 10-Hmeeo|17-Hydroxy-10-mercaptoestr-4-en-3-one|7-Jod-heptansaeure-aethylester|10beta-Hydroxy-10beta-mercaptoestr-4-en-one|17-Hydroxy-10-sulfanylestr-4-en-3-one|10|A-Mercapto-17|A-hydroxy-oestr-4-en-3-on|10 beta-hydroxy-10 beta-mercaptoestr-4-en-one|(10xi)-17beta-Hydroxy-10-sulfanylestr-4-en-3-one|Estr-4-en-3-one, 17-hydroxy-10-mercapto-, (17beta)-|(8S,9S,13S,14S,17S)-17-hydroxy-13-methyl-10-sulfanyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
| Molecular Formula | C18H26O2S |
|---|---|
| Molecular Weight | 306.16534 g/mol |
| LogP | 3.5415 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 306.16534 |
| Monoisotopic Mass | 306.16534 |
| Heavy Atoms | 21 |
| Complexity | 513.3477 |
Chemical Identifiers
| CAS Number | 51101-80-5 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)CCC34S |
Product Overview
17-Hydroxy-10-mercaptoestr-4-en-3-one (CAS 51101-80-5), with molecular formula C18H26O2S and molecular weight 306.16534 g/mol. IUPAC: (8S,9S,13S,14S,17S)-17-hydroxy-13-methyl-10-sulfanyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.