| SpectraBase Compound ID | BkJOymUIdHC |
|---|---|
| InChI | InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1 |
| InChIKey | OIGNJSKKLXVSLS-VWUMJDOOSA-N |
| Mol Weight | 360.45 g/mol |
| Molecular Formula | C21H28O5 |
| Exact Mass | 360.193674 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Glq5LaRw8DO |
|---|---|
| Name | 11-BETA,17-ALPHA,21-TRIHYDROXYPREGNA-1,4-DIEN-3,20-DION |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H28O5 |
| InChI | InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1 |
| InChIKey | OIGNJSKKLXVSLS-VWUMJDOOSA-N |
| Literature Reference Author | M.D.GONZALEZ,G.BURTON |
| Literature Reference Citation | ORG.MAGN.RES.,22,586(1984) |
| Literature Reference DOI | 10.1002/mrc.1270220914 |
| Molecular Weight | 360.450 g/mol |
| Solvent | CDCl3:CD3OD=95:5 |
| Source File Reference | UNIW12730 |