| SpectraBase Spectrum ID |
BosvCPYYK9s |
| Name |
ESTRA-1,3,5(10)-TRIENE-3,17.ALPHA.-DIOL-6-ONE(3,17.ALPHA.-DI-ACETATE) |
| Alternate Name(s) |
17-(ACETYLOXY)-6-OXOESTRA-1(10),2,4-TRIEN-3-YL ACETATE |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C22H26O5 |
| InChI |
InChI=1S/C22H26O5/c1-12(23)26-14-4-5-15-16-8-9-22(3)19(6-7-21(22)27-13(2)24)17(16)11-20(25)18(15)10-14/h4-5,10,16-17,19,21H,6-9,11H2,1-3H3 |
| InChIKey |
REXFWMANWYNMPV-UHFFFAOYSA-N |
| Nominal Mass |
370 u |
| Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
| SMILES |
C12CC(c3cc(OC(C)=O)ccc3C2CCC2(C)C(CCC12)OC(C)=O)=O |
| SPLASH |
splash10-004i-2698000000-59c8269b338afd853b73 |
| Source File Reference |
LMCM-99319-970F |
| Source of Spectrum |
Copyright (C) Dr. Makin, London Hospital Medical College, UK |
