| SpectraBase Spectrum ID |
C2UZZeHSakF |
| Name |
16.alpha.-Iodo-11.beta.-ethoxyestra-1,3,5(10)-triene-3,17.beta.-diol |
| Alternate Name(s) |
(11beta,16alpha,17beta)-11-ethoxy-16-iodoestra-1,3,5(10)-triene-3,17-diol
(8S,9S,11S,13S,14S,16R,17R)-11-ethoxy-16-iodanyl-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H27IO3 |
| InChI |
InChI=1S/C20H27IO3/c1-3-24-17-10-20(2)15(9-16(21)19(20)23)14-6-4-11-8-12(22)5-7-13(11)18(14)17/h5,7-8,14-19,22-23H,3-4,6,9-10H2,1-2H3/t14-,15-,16+,17-,18+,19-,20-/m0/s1 |
| InChIKey |
ZMCGGWRJQVTFIY-FLIUJYPFSA-N |
| Molecular Weight |
442.337 g/mol |
| SMILES |
O[C@]1([C@@](C[C@]2([C@@]3(CCc4c(ccc(c4)O)[C@]3([C@](C[C@]12C)(OCC)[H])[H])[H])[H])(I)[H])[H] |
| SPLASH |
splash10-0btc-0490200000-8b6acbef43f7a451d5a5 |
| Source of Spectrum |
E1-36-269-9 |
| Wiley ID |
1574619 |
