| SpectraBase Spectrum ID |
9k6xZMwhPeS |
| Name |
ESTRA-1,3,5(10)-TRIENE-3,17.BETA.-DIOL(3,17.BETA.-DI-ACETATE) |
| Alternate Name(s) |
17-(ACETYLOXY)ESTRA-1,3,5(10)-TRIEN-3-YL ACETATE |
| CAS Registry Number |
3434-88-6 |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C22H28O4 |
| InChI |
InChI=1S/C22H28O4/c1-13(23)25-16-5-7-17-15(12-16)4-6-19-18(17)10-11-22(3)20(19)8-9-21(22)26-14(2)24/h5,7,12,18-21H,4,6,8-11H2,1-3H3 |
| InChIKey |
VQHQLBARMFAKSV-UHFFFAOYSA-N |
| Nominal Mass |
356 u |
| Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
| SMILES |
CC12C(OC(=O)C)CCC2C2CCc3cc(ccc3C2CC1)OC(=O)C |
| SPLASH |
splash10-03di-1739000000-bc955f770b989353e3c7 |
| Source File Reference |
LMCM-96058-804S |
| Source of Spectrum |
Copyright (C) Dr. Makin, London Hospital Medical College, UK |
