| SpectraBase Spectrum ID |
5tfruEsoD2L |
| Name |
3.ALPHA.,11.BETA.,21-TRIHYDROXY-5.ALPHA.-PREGNAN-20-ONE |
| Alternate Name(s) |
3,11,21-TRIHYDROXYPREGNAN-20-ONE |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C21H34O4 |
| InChI |
InChI=1S/C21H34O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h12-17,19,22-24H,3-11H2,1-2H3 |
| InChIKey |
RHQQHZQUAMFINJ-UHFFFAOYSA-N |
| Nominal Mass |
350 u |
| Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
| SMILES |
C12(C)C(C(CO)=O)CCC2C2CCC3C(CCC(O)C3)(C)C2C(O)C1 |
| SPLASH |
splash10-066r-7639000000-b1e70dc1fa30acea8a24 |
| Source File Reference |
LMCM-34908-309V |
| Source of Spectrum |
Copyright (C) Prof. Spiteller, University Bayreuth, Germany |
