| SpectraBase Compound ID | t2jAS1AslX |
|---|---|
| InChI | InChI=1S/C21H30O6/c1-10(22)21-17(27-21)7-13-11-6-16(25)20(26)9-15(24)14(23)8-19(20,3)12(11)4-5-18(13,21)2/h11-15,17,23-24,26H,4-9H2,1-3H3/t11-,12+,13+,14-,15+,17-,18+,19-,20+,21-/m1/s1 |
| InChIKey | HTGAEPGKDZOAFM-NZZXLGMLSA-N |
| Mol Weight | 378.47 g/mol |
| Molecular Formula | C21H30O6 |
| Exact Mass | 378.204239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 76botLlckdE |
|---|---|
| Name | 16-ALPHA,17-ALPHA-EPOXY-2-ALPHA,3-ALPHA,5-TRIHYDROXY-5-ALPHA-PREGNA-6,20-DIONE |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H30O6 |
| InChI | InChI=1S/C21H30O6/c1-10(22)21-17(27-21)7-13-11-6-16(25)20(26)9-15(24)14(23)8-19(20,3)12(11)4-5-18(13,21)2/h11-15,17,23-24,26H,4-9H2,1-3H3/t11-,12+,13+,14-,15+,17-,18+,19-,20+,21-/m1/s1 |
| InChIKey | HTGAEPGKDZOAFM-NZZXLGMLSA-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 | 378.466 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU30250 |