| SpectraBase Spectrum ID |
5pg0p1Qt6El |
| Name |
3-( 17'.beta.-Acetylandrosta-3',5'-dien-3'-yl)-5,5-dimethylfuran-2(5H)-one |
| Alternate Name(s) |
5,5-Dimethyl-3-(20-oxopregna-3,5-dien-3-yl)-2(5H)-furanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H36O3 |
| InChI |
InChI=1S/C27H36O3/c1-16(28)21-8-9-22-19-7-6-18-14-17(20-15-25(2,3)30-24(20)29)10-12-26(18,4)23(19)11-13-27(21,22)5/h6,14-15,19,21-23H,7-13H2,1-5H3/t19?,21-,22?,23?,26+,27-/m1/s1 |
| InChIKey |
WQDWWNPBLLVVCN-RNYJGSKZSA-N |
| Molecular Weight |
408.582 g/mol |
| SMILES |
[C@@]12(C(C3CC=C4[C@@](C3CC2)(CCC(C=2C(OC(C2)(C)C)=O)=C4)C)CC[C@@]1(C(=O)C)[H])C |
| SPLASH |
splash10-0a4i-0003900000-56c07b90bcb09462cc70 |
| Source of Spectrum |
U1-1999-3312-11 |
| Wiley ID |
753520 |
