| SpectraBase Spectrum ID |
KoWWEPPI7Kb |
| Name |
3-O-Ethoxymethyl-17.alpha.-[(1-hydroxycyclohexyl)methyl]-17.beta.-estradiol |
| Alternate Name(s) |
1-{[(17beta)-3-(ethoxymethoxy)-17-hydroxyestra-1,3,5(10)-trien-17-yl]methyl}cyclohexanol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H42O4 |
| InChI |
InChI=1S/C28H42O4/c1-3-31-19-32-21-8-10-22-20(17-21)7-9-24-23(22)11-15-26(2)25(24)12-16-28(26,30)18-27(29)13-5-4-6-14-27/h8,10,17,23-25,29-30H,3-7,9,11-16,18-19H2,1-2H3/t23-,24-,25+,26+,28-/m1/s1 |
| InChIKey |
USOOFSFLHABYBO-DNAQHQBMSA-N |
| Molecular Weight |
442.640 g/mol |
| SMILES |
OC1(C[C@]2([C@@]3([C@]([C@@]4(CCc5c([C@]4(CC3)[H])ccc(OCOCC)c5)[H])(CC2)[H])C)O)CCCCC1 |
| SPLASH |
splash10-0a4i-9000000000-232558cf846e907180f3 |
| Source of Spectrum |
KD-12-805-3 |
| Wiley ID |
1634312 |
![3-O-Ethoxymethyl-17.alpha.-[(1-hydroxycyclohexyl)methyl]-17.beta.-estradiol](/api/spectrum/KoWWEPPI7Kb/structure.png?h=300&w=458 "3-O-Ethoxymethyl-17.alpha.-[(1-hydroxycyclohexyl)methyl]-17.beta.-estradiol")
