| SpectraBase Compound ID | HEOExWRU8sP |
|---|---|
| InChI | InChI=1S/C25H40O6/c1-15(26)30-14-22(28)25(29)12-9-21-19-6-5-17-13-18(31-16(2)27)7-10-23(17,3)20(19)8-11-24(21,25)4/h17-22,28-29H,5-14H2,1-4H3/t17-,18-,19-,20+,21+,22+,23+,24+,25+/m1/s1 |
| InChIKey | FYYNAGPWSAPXJV-ZRNXLIBUSA-N |
| Mol Weight | 436.6 g/mol |
| Molecular Formula | C25H40O6 |
| Exact Mass | 436.282489 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2fAffnAQeub |
|---|---|
| Name | 5β-pregnane-3α,17,20α,21-tetrol, 3,21-diacetate |
| Copyright | Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H40O6 |
| InChI | InChI=1S/C25H40O6/c1-15(26)30-14-22(28)25(29)12-9-21-19-6-5-17-13-18(31-16(2)27)7-10-23(17,3)20(19)8-11-24(21,25)4/h17-22,28-29H,5-14H2,1-4H3/t17-,18-,19-,20+,21+,22+,23+,24+,25+/m1/s1 |
| InChIKey | FYYNAGPWSAPXJV-ZRNXLIBUSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 41658M |
| Solvent | CDCl3 |