| SpectraBase Spectrum ID |
9Cq6KITrkO |
| Name |
3.BETA.,17.ALPHA.,20.BETA.,21-TETRAHYDROXY-5.ALPHA.-PREGNAN |
| Alternate Name(s) |
PREGNANE-3,17,20,21-TETROL |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C21H36O4 |
| InChI |
InChI=1S/C21H36O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h13-18,22-25H,3-12H2,1-2H3 |
| InChIKey |
MQSSTQLJJOVNQF-UHFFFAOYSA-N |
| Nominal Mass |
352 u |
| Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
| SMILES |
C12(C)CCC3C(CCC4C3(C)CCC(O)C4)C2CCC1(O)C(CO)O |
| SPLASH |
splash10-0006-9430000000-0c63a7767b2dc92349fb |
| Source File Reference |
LMCM-27280-184C |
| Source of Spectrum |
Copyright (C) Prof. Spiteller, University Bayreuth, Germany |
