| SpectraBase Spectrum ID |
9qB20t99fqz |
| Name |
21-ACETOXY-5.BETA.-PREGNAN-3.BETA.,4.BETA.-DIOL-20-ONE |
| Alternate Name(s) |
3,4-DIHYDROXY-20-OXOPREGNAN-21-YL ACETATE |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C23H36O5 |
| InChI |
InChI=1S/C23H36O5/c1-13(24)28-12-20(26)17-7-6-15-14-4-5-18-21(27)19(25)9-11-23(18,3)16(14)8-10-22(15,17)2/h14-19,21,25,27H,4-12H2,1-3H3 |
| InChIKey |
SDOZYKASEMOZHV-UHFFFAOYSA-N |
| Nominal Mass |
392 u |
| Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
| SMILES |
C12(C)CCC(O)C(O)C2CCC2C1CCC1(C2CCC1C(=O)COC(C)=O)C |
| SPLASH |
splash10-066r-8349000000-af29a4093245f05d83b1 |
| Source File Reference |
LMCM-65388-762B |
| Source of Spectrum |
Copyright (C) Prof. Spiteller, University Bayreuth, Germany |
