| SpectraBase Compound ID | 3DMbtwuFDLm |
|---|---|
| InChI | InChI=1S/C23H38O4/c1-14(24)23(26)12-9-20-18-6-5-16-13-17(27-15(2)25)7-10-21(16,3)19(18)8-11-22(20,23)4/h14,16-20,24,26H,5-13H2,1-4H3/t14-,16-,17-,18-,19+,20+,21+,22+,23+/m1/s1 |
| InChIKey | BODQHLHCRGRRSI-NXFDXQIRSA-N |
| Mol Weight | 378.6 g/mol |
| Molecular Formula | C23H38O4 |
| Exact Mass | 378.27701 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5oQbDjFz0CX |
|---|---|
| Name | 5β-pregnane-3α,17,20β-triol, 3-acetate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H38O4 |
| InChI | InChI=1S/C23H38O4/c1-14(24)23(26)12-9-20-18-6-5-16-13-17(27-15(2)25)7-10-21(16,3)19(18)8-11-22(20,23)4/h14,16-20,24,26H,5-13H2,1-4H3/t14-,16-,17-,18-,19+,20+,21+,22+,23+/m1/s1 |
| InChIKey | BODQHLHCRGRRSI-NXFDXQIRSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 39947M |
| Solvent | CDCl3 |