| SpectraBase Spectrum ID |
4gaaxJaSQ4p |
| Name |
4-Fluoro-7.alpha.-methyl-17.alpha.-ethynyl-1(10),2,4-trien-estra-3,17.beta.-diol |
| Alternate Name(s) |
(7alpha,17beta)-17-ethynyl-4-fluoro-7-methylestra-1(10),2,4-triene-3,17-diol
(7R,13S,17R)-17-ethynyl-4-fluoranyl-7,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
(7R,13S,17R)-17-ethynyl-4-fluoro-7,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
4-Fluoro-7-methyl-17.alpha.-ethynylestra-3,17-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25FO2 |
| InChI |
InChI=1S/C21H25FO2/c1-4-21(24)10-8-16-18-12(2)11-15-13(5-6-17(23)19(15)22)14(18)7-9-20(16,21)3/h1,5-6,12,14,16,18,23-24H,7-11H2,2-3H3/t12-,14?,16?,18?,20+,21+/m1/s1 |
| InChIKey |
CUSUNOCLNDQSQL-PNTKPLNPSA-N |
| Molecular Weight |
328.427 g/mol |
| SMILES |
O[C@]1(CCC2[C@@]1(CCC1c3c(c(c(cc3)O)F)C[C@](C21)(C)[H])C)C#C |
| SPLASH |
splash10-0002-0094000000-5bde9d34e1b32cb06931 |
| Source of Spectrum |
E1-36-3064-5 |
| Wiley ID |
1574771 |
