| SpectraBase Spectrum ID |
8c3FL3AJLfz |
| Name |
ESTRA-1,3,5(10)-TRIENE-2-BROMO-3,17.BETA.-DIOL(3,17.BETA.-DI-ACETATE) |
| Alternate Name(s) |
17-(ACETYLOXY)-2-BROMOESTRA-1(10),2,4-TRIEN-3-YL ACETATE |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C22H27BrO4 |
| InChI |
InChI=1S/C22H27BrO4/c1-12(24)26-20-10-14-4-5-16-15(17(14)11-19(20)23)8-9-22(3)18(16)6-7-21(22)27-13(2)25/h10-11,15-16,18,21H,4-9H2,1-3H3 |
| InChIKey |
SJEALCGIPRMQHF-UHFFFAOYSA-N |
| Nominal Mass |
434 u |
| Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
| SMILES |
C12(C)CCC3C(CCc4cc(OC(C)=O)c(Br)cc34)C2CCC1OC(C)=O |
| SPLASH |
splash10-0006-0239000000-9fbb5d55d922492ee33a |
| Source File Reference |
LMCM-27478-700T |
| Source of Spectrum |
Copyright (C) Dr. Makin, London Hospital Medical College, UK |
