| SpectraBase Compound ID | 9f41RtKedag |
|---|---|
| InChI | InChI=1S/C22H34O6/c1-11(23)19-17(28-4)8-14-12-7-18(26)22(27)10-16(25)15(24)9-21(22,3)13(12)5-6-20(14,19)2/h12-17,19,24-25,27H,5-10H2,1-4H3/t12-,13+,14+,15-,16+,17-,19+,20+,21-,22+/m1/s1 |
| InChIKey | VPHDYXJBQJPWLL-ZLFUDNJESA-N |
| Mol Weight | 394.5 g/mol |
| Molecular Formula | C22H34O6 |
| Exact Mass | 394.235539 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ej5ndVADiJ5 |
|---|---|
| Name | 2-ALPHA,3-ALPHA,5-TRIHYDROXY-16-ALPHA-METHOXY-5-ALPHA-PREGNA-6,20-DIONE |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H34O6 |
| InChI | InChI=1S/C22H34O6/c1-11(23)19-17(28-4)8-14-12-7-18(26)22(27)10-16(25)15(24)9-21(22,3)13(12)5-6-20(14,19)2/h12-17,19,24-25,27H,5-10H2,1-4H3/t12-,13+,14+,15-,16+,17-,19+,20+,21-,22+/m1/s1 |
| InChIKey | VPHDYXJBQJPWLL-ZLFUDNJESA-N |
| Literature Reference Author | D.G.RIVERA,F.COLL |
| Literature Reference Citation | CAN.J.CHEM.,83,1084(2005) |
| Literature Reference DOI | 10.1139/v05-051 |
| Molecular Weight | 394.508 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU30248 |