| SpectraBase Spectrum ID |
7ZyLkXfvqfg |
| Name |
ESTRA-1,3,5(10)-TRIENE-3,17.BETA.-DIOL-16-ONE(3,17.BETA.-DI-ACETATE) |
| Alternate Name(s) |
17-(ACETYLOXY)-16-OXOESTRA-1(10),2,4-TRIEN-3-YL ACETATE |
| CAS Registry Number |
1247-47-8 |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C22H26O5 |
| InChI |
InChI=1S/C22H26O5/c1-12(23)26-15-5-7-16-14(10-15)4-6-18-17(16)8-9-22(3)19(18)11-20(25)21(22)27-13(2)24/h5,7,10,17-19,21H,4,6,8-9,11H2,1-3H3 |
| InChIKey |
RADJLYXZKCROSL-UHFFFAOYSA-N |
| Nominal Mass |
370 u |
| Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
| SMILES |
C12(C)CCC3C(CCc4cc(OC(C)=O)ccc34)C2CC(=O)C1OC(C)=O |
| SPLASH |
splash10-004i-0439000000-1713cd3877b9c0ac6bf3 |
| Source File Reference |
LMCM-56482-541U |
| Source of Spectrum |
Copyright (C) Dr. Makin, London Hospital Medical College, UK |
