| SpectraBase Spectrum ID |
5Eo63XeCiMB |
| Name |
Pregna-1,20-dien-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30O |
| InChI |
InChI=1S/C21H30O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h4,9,11,14-15,17-19H,1,5-8,10,12-13H2,2-3H3/t14-,15?,17-,18-,19-,20+,21-/m0/s1 |
| InChIKey |
JIFKGXKDITUDPD-ZBKBXNIDSA-N |
| Molecular Weight |
298.470 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)(C=C)[H])[H])([H])CCC2CC(=O)C=C1)[H])C |
| SPLASH |
splash10-0631-8930000000-8ead6216241ebabb14be |
| Source of Spectrum |
G4-62-319-1 |
| Synonyms |
(8S,9S,10R,13R,14S,17R)-17-ethenyl-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one |
| Wiley ID |
1607761 |
