| SpectraBase Spectrum ID |
1gbcaIMViLx |
| Name |
ANDROSTA-1,4-DIENE-16.BETA.-OL-3-ONE(16.BETA.-ACETATE) |
| Alternate Name(s) |
3-OXOANDROSTA-1,4-DIEN-16-YL ACETATE |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C21H28O3 |
| InChI |
InChI=1S/C21H28O3/c1-13(22)24-16-11-19-17-5-4-14-10-15(23)6-9-21(14,3)18(17)7-8-20(19,2)12-16/h6,9-10,16-19H,4-5,7-8,11-12H2,1-3H3 |
| InChIKey |
BNMQPIVTTFUBSY-UHFFFAOYSA-N |
| Nominal Mass |
328 u |
| Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
| SMILES |
C12(C)C=CC(C=C2CCC2C1CCC1(C2CC(C1)OC(C)=O)C)=O |
| SPLASH |
splash10-0096-4910000000-28baf6268c7f9dfb87ad |
| Source File Reference |
LMCM-64850-068K |
| Source of Spectrum |
Copyright (C) Dr. Makin, London Hospital Medical College, UK |
