| SpectraBase Spectrum ID |
Eqaq5KhWdp |
| Name |
Ethisterone |
| Alternate Name(s) |
17.alpha.-Pregn-4-en-20-yn-3-one, 17-hydroxy-
Anhydroxyprogesterone
17.alpha.-Ethynyltestosterone
(8R,9S,10R,13S,14S,17R)-17-ethynyl-17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H28O2 |
| InChI |
InChI=1S/C21H28O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h1,13,16-18,23H,5-12H2,2-3H3/t16-,17+,18+,19+,20+,21+/m1/s1 |
| InChIKey |
CHNXZKVNWQUJIB-CEGNMAFCSA-N |
| Molecular Weight |
312.453 g/mol |
| SMILES |
O[C@]1(CC[C@]2([C@@]3(CCC4=CC(CC[C@@]4([C@]3(CC[C@]12C)[H])C)=O)[H])[H])C#C |
| SPLASH |
splash10-05dl-5920000000-e9c6569271ea21d885ec |
| Source of Spectrum |
SWG-33-1339-0 |
| Wiley ID |
1809138 |
