| SpectraBase Spectrum ID |
2kASePMFOI3 |
| Name |
ESTRA-1,3,5(10)-TRIENE-1-METHYL-3-OL-17-ONE(3-ACETATE) |
| Alternate Name(s) |
1-METHYL-17-OXOESTRA-1(10),2,4-TRIEN-3-YL ACETATE |
| CAS Registry Number |
30903-07-2 |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C21H26O3 |
| InChI |
InChI=1S/C21H26O3/c1-12-10-15(24-13(2)22)11-14-4-5-16-17(20(12)14)8-9-21(3)18(16)6-7-19(21)23/h10-11,16-18H,4-9H2,1-3H3 |
| InChIKey |
DSYUIGGWBXWDGI-UHFFFAOYSA-N |
| Nominal Mass |
326 u |
| Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
| SMILES |
C12CCC3(C(CCC3=O)C1CCc1cc(OC(C)=O)cc(C)c21)C |
| SPLASH |
splash10-001i-1791000000-50b041f94e9767ce9486 |
| Source File Reference |
LMCM-56931-748K |
| Source of Spectrum |
Copyright (C) Dr. Makin, London Hospital Medical College, UK |
