| SpectraBase Spectrum ID |
3jqiiCPSIXH |
| Name |
Pregna-1,4-diene-3,20-dione, cyclic 20-(1,2-ethanediyl mercaptole) |
| CAS Registry Number |
66450-90-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H32OS2 |
| InChI |
InChI=1S/C23H32OS2/c1-21-10-8-16(24)14-15(21)4-5-17-18-6-7-20(23(3)25-12-13-26-23)22(18,2)11-9-19(17)21/h8,10,14,17-20H,4-7,9,11-13H2,1-3H3/t17-,18-,19-,20-,21-,22-/m0/s1 |
| InChIKey |
SZXBGQBSIODYFJ-WLNPFYQQSA-N |
| Molecular Weight |
388.628 g/mol |
| SMILES |
[C@@]12(C(=CC(C=C2)=O)CC[C@]2([C@@]3(CC[C@@]([C@]3(CC[C@]12[H])C)(C1(SCCS1)C)[H])[H])[H])C |
| SPLASH |
splash10-014i-0900000000-a69e163ce0eeb50dba83 |
| Source of Spectrum |
KC-1979-2067-0 |
| Synonyms |
(17beta)-17-(2-methyl-1,3-dithiolan-2-yl)androsta-1,4-dien-3-one
Pregna-1,4-diene-3,20-dione20-ethylene dithioacetal |
| Wiley ID |
1363937 |
