| SpectraBase Spectrum ID |
B17AuOeXHLk |
| Name |
3-[3'-(Benzyloxy)estra-1',3',5'(10')-trien-17'-yloxy]-1-propanol |
| Alternate Name(s) |
3-{[3-(benzyloxy)estra-1,3,5(10)-trien-17-yl]oxy}-1-propanol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H36O3 |
| InChI |
InChI=1S/C28H36O3/c1-28-15-14-24-23-11-9-22(31-19-20-6-3-2-4-7-20)18-21(23)8-10-25(24)26(28)12-13-27(28)30-17-5-16-29/h2-4,6-7,9,11,18,24-27,29H,5,8,10,12-17,19H2,1H3/t24?,25?,26?,27?,28-/m0/s1 |
| InChIKey |
XVIYYQJTPPFETN-ONCJYJFXSA-N |
| Molecular Weight |
420.593 g/mol |
| SMILES |
OCCCOC1[C@@]2(C(C3CCc4c(C3CC2)ccc(OCc2ccccc2)c4)CC1)C |
| SPLASH |
splash10-006x-9000800000-83cfd5a9e0c54d9358f6 |
| Source of Spectrum |
U-1995-1627-23 |
| Wiley ID |
767639 |
![3-[3'-(Benzyloxy)estra-1',3',5'(10')-trien-17'-yloxy]-1-propanol](/api/spectrum/B17AuOeXHLk/structure.png?h=300&w=458 "3-[3'-(Benzyloxy)estra-1',3',5'(10')-trien-17'-yloxy]-1-propanol")
