SpectraBase Spectrum ID |
7auioJOMDdv |
Name |
7.beta.-hydroxy-3-methoxyestra-1,3,5(10),9(11)-tetraen-17-one |
CAS Registry Number |
116503-19-6 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H22O3 |
InChI |
InChI=1S/C19H22O3/c1-19-8-7-14-13-4-3-12(22-2)9-11(13)10-16(20)18(14)15(19)5-6-17(19)21/h3-4,7,9,15-16,18,20H,5-6,8,10H2,1-2H3/t15-,16-,18+,19-/m0/s1 |
InChIKey |
IMHXUSNFLJZUOK-DKKFBQAASA-N |
Molecular Weight |
298.382 g/mol |
SMILES |
O[C@@]1([C@]2([C@@]3(CCC([C@]3(CC=C2c2c(C1)cc(cc2)OC)C)=O)[H])[H])[H] |
SPLASH |
splash10-0002-0090000000-968f2175f6d2cde045a8 |
Source of Spectrum |
J-53-5537-10 |
Synonyms |
(7beta)-7-hydroxy-3-methoxyestra-1,3,5(10),9(11)-tetraen-17-one |
Wiley ID |
1301270 |