| SpectraBase Spectrum ID |
94zixnRWZSz |
| Name |
(16alpha,17beta)-17-ethynyl-16-fluoroestra-1,3,5(10)-triene-3,17-diol |
| CAS Registry Number |
92817-14-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H23FO2 |
| InChI |
InChI=1S/C20H23FO2/c1-3-20(23)18(21)11-17-16-6-4-12-10-13(22)5-7-14(12)15(16)8-9-19(17,20)2/h1,5,7,10,15-18,22-23H,4,6,8-9,11H2,2H3/t15-,16-,17+,18-,19+,20+/m1/s1 |
| InChIKey |
IFDRGXJMFGLUCN-NADOGSGZSA-N |
| Molecular Weight |
314.400 g/mol |
| SMILES |
Oc1ccc2c(CC[C@]3([C@]4([C@@]([C@@]([C@@](C4)(F)[H])(C#C)O)(CC[C@]23[H])C)[H])[H])c1 |
| SPLASH |
splash10-03di-0094000000-e280321fad85af9115da |
| Source of Spectrum |
J-49-4905-0 |
| Synonyms |
(8R,9S,13S,14S,16R,17R)-17-ethynyl-16-fluoranyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
(8R,9S,13S,14S,16R,17R)-17-ethynyl-16-fluoro-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
17-Ethynyl-16-fluoroestradiol
17-Ethynyl-fes
19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, 16-fluoro-, (16alpha,17alpha)- |
| Wiley ID |
1315383 |
