| SpectraBase Spectrum ID |
JWTc2UPwNjr |
| Name |
3-Methoxy-Estra-1,3,5(10),9(11)-tetraen-12-one |
| Alternate Name(s) |
(8S,13R,14S)-3-methoxy-13-methyl-6,7,8,13,14,15,16,17-octahydro-12H-cyclopenta[a]phenanthren-12-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H22O2 |
| InChI |
InChI=1S/C19H22O2/c1-19-9-3-4-17(19)15-7-5-12-10-13(21-2)6-8-14(12)16(15)11-18(19)20/h6,8,10-11,15,17H,3-5,7,9H2,1-2H3/t15-,17+,19-/m1/s1 |
| InChIKey |
VBDXXHJNCZBKFZ-HHXXYDBFSA-N |
| Molecular Weight |
282.383 g/mol |
| SMILES |
c1c(OC)cc2CC[C@@]3([H])[C@]4([H])CCC[C@@]4(C)C(=O)C=C3c2c1 |
| SPLASH |
splash10-0ue9-0090000000-2fab5b3a5bee1898d1c1 |
| Source of Spectrum |
K-104-2399-6f |
| Wiley ID |
1793440 |
