| SpectraBase Spectrum ID |
6IlVXHTMawa |
| Name |
3,17beta-Dihydroxy-17alpha-methyl-Estra-1,3,5(10),9(11)-tetraen-12-one |
| Alternate Name(s) |
(8S,13S,14S,17S)-3,17-dihydroxy-13,17-dimethyl-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 |
C19H22O3 |
| InChI |
InChI=1S/C19H22O3/c1-18(22)8-7-16-14-5-3-11-9-12(20)4-6-13(11)15(14)10-17(21)19(16,18)2/h4,6,9-10,14,16,20,22H,3,5,7-8H2,1-2H3/t14-,16+,18+,19-/m1/s1 |
| InChIKey |
GARYWLZWCLNTDW-TWKWOARYSA-N |
| Literature Reference DOI |
10.1002/cber.19711040807 |
| Molecular Weight |
298.382 g/mol |
| SMILES |
O[C@@]1([C@]2(C(C=C3[C@@](CCc4cc(ccc34)O)([C@@]2(CC1)[H])[H])=O)C)C |
| SPLASH |
splash10-056s-0390000000-416c70c079719c21e4e7 |
| Source of Spectrum |
K-104-2402-6d |
| Wiley ID |
1793438 |
