| SpectraBase Spectrum ID |
5YeyHvItuTF |
| Name |
3,3-Ethylenedioxy-12.beta.,18-cyclo-5-pregnene-11,20-dione |
| Alternate Name(s) |
(1'S,2'S,5'S,6'S,8'S,10'S,11'R)-5'-acetyl-11'-methylspiro[1,3-dioxolane-2,14'-pentacyclo[8.8.0.0(2,6).0(6,8).0(11,16)]octadecan]-16'-en-9'-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H30O4 |
| InChI |
InChI=1S/C23H30O4/c1-13(24)16-5-6-17-15-4-3-14-11-22(26-9-10-27-22)8-7-21(14,2)19(15)20(25)18-12-23(16,17)18/h3,15-19H,4-12H2,1-2H3/t15-,16+,17-,18+,19+,21-,23+/m0/s1 |
| InChIKey |
XYQAKJRPUYYKBC-CFAHEAAPSA-N |
| Molecular Weight |
370.489 g/mol |
| SMILES |
[C@]123[C@@](C(=O)[C@]4([C@]([C@@]3(CC[C@@]1(C(=O)C)[H])[H])(CC=C1CC3(OCCO3)CC[C@]41C)[H])[H])(C2)[H] |
| SPLASH |
splash10-0002-9000000000-dd5ad2800c7ff13d050f |
| Source of Spectrum |
AT-37-932-6 |
| Wiley ID |
853470 |
