| SpectraBase Spectrum ID |
49IemECG8oU |
| Name |
3,16-diacetoxy-estra-1,3,5(10)-triene-17-ol |
| Alternate Name(s) |
16-(acetyloxy)-17-hydroxyestra-1,3,5(10)-trien-3-yl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O5 |
| InChI |
InChI=1S/C22H28O5/c1-12(23)26-15-5-7-16-14(10-15)4-6-18-17(16)8-9-22(3)19(18)11-20(21(22)25)27-13(2)24/h5,7,10,17-21,25H,4,6,8-9,11H2,1-3H3/t17-,18-,19+,20?,21?,22+/m1/s1 |
| InChIKey |
GNGATPZQRQSIHC-LLFYEVKUSA-N |
| Molecular Weight |
372.461 g/mol |
| SMILES |
OC1C(OC(=O)C)C[C@@]2([C@@]1(CC[C@@]1(c3c(cc(cc3)OC(=O)C)CC[C@@]21[H])[H])C)[H] |
| SPLASH |
splash10-074i-1942000000-a816776da86f250e5a99 |
| Source of Spectrum |
CJ-1992-0-0 |
| Wiley ID |
1355586 |
