| SpectraBase Spectrum ID |
5t1vA1yQ1h2 |
| Name |
3-Methoxy-21a-homo-19-norpregna-1,3,5(10),16-tetraen-20-one |
| Alternate Name(s) |
1-[3-methoxyestra-1,3,5(10),16-tetraen-17-yl]-1-propanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O2 |
| InChI |
InChI=1S/C22H28O2/c1-4-21(23)20-10-9-19-18-7-5-14-13-15(24-3)6-8-16(14)17(18)11-12-22(19,20)2/h6,8,10,13,17-19H,4-5,7,9,11-12H2,1-3H3/t17-,18-,19+,22+/m1/s1 |
| InChIKey |
TWTTUNWLXAEKTD-IWQHBPENSA-N |
| Molecular Weight |
324.464 g/mol |
| SMILES |
c1(ccc2c(c1)CC[C@]1([C@@]3(CC=C(C(CC)=O)[C@@]3(C)CC[C@]21[H])[H])[H])OC |
| SPLASH |
splash10-00di-2119000000-1fcdd661c4e82ae9ff4e |
| Source of Spectrum |
U-1993-1102-4 |
| Wiley ID |
765325 |
