| SpectraBase Spectrum ID |
DLf5ZHusu5V |
| Name |
3-Hydroxy-Estra-1,3,5(10),9(11)-tetraen-12,17-dione |
| Alternate Name(s) |
(8S,13S,14S)-3-hydroxy-13-methyl-7,8,13,14,15,16-hexahydro-6H-cyclopenta[a]phenanthrene-12,17-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18O3 |
| InChI |
InChI=1S/C18H18O3/c1-18-15(6-7-16(18)20)13-4-2-10-8-11(19)3-5-12(10)14(13)9-17(18)21/h3,5,8-9,13,15,19H,2,4,6-7H2,1H3/t13-,15+,18+/m1/s1 |
| InChIKey |
DTNSOKRSXUIHIZ-XUWXXGDYSA-N |
| Literature Reference DOI |
10.1002/cber.19711040807 |
| Molecular Weight |
282.339 g/mol |
| SMILES |
Oc1cc2c(cc1)C=1[C@@](CC2)([C@]2([C@@](C(C1)=O)(C)C(CC2)=O)[H])[H] |
| SPLASH |
splash10-052r-0900000000-f082de9b427e30b55e3c |
| Source of Spectrum |
K-104-2398-6b |
| Wiley ID |
1793436 |
