| SpectraBase Compound ID | 343sQk2r3nD |
|---|---|
| InChI | InChI=1S/C27H42O4/c1-16-7-12-27(30-15-16)17(2)23-25(4)11-9-21-20(22(25)14-26(23,29)31-27)6-5-18-13-19(28)8-10-24(18,21)3/h5,16-17,19-23,28-29H,6-15H2,1-4H3/t16-,17-,19-,20+,21-,22-,23+,24-,25-,26-,27+/m0/s1 |
| InChIKey | PPYGRNPCXQIBST-YVOQUZMQSA-N |
| Mol Weight | 430.6 g/mol |
| Molecular Formula | C27H42O4 |
| Exact Mass | 430.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AdGQI3elAlr |
|---|---|
| Name | 16-ALPHA-HYDROXYDIOSGENIN=(25R)-5-SPIROSTEN-3-BETA,16-ALPHA-DIOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O4 |
| InChI | InChI=1S/C27H42O4/c1-16-7-12-27(30-15-16)17(2)23-25(4)11-9-21-20(22(25)14-26(23,29)31-27)6-5-18-13-19(28)8-10-24(18,21)3/h5,16-17,19-23,28-29H,6-15H2,1-4H3/t16-,17-,19-,20+,21-,22-,23+,24-,25-,26-,27+/m0/s1 |
| InChIKey | PPYGRNPCXQIBST-YVOQUZMQSA-N |
| Literature Reference Author | P.K.AGRAWAL,D.C.JAIN,R.K.GUPTA,R.S.THAKUR |
| Literature Reference Citation | PHYTOCHEM.,24,2479(1985) |
| Literature Reference DOI | 10.1016/S0031-9422(00)80653-6 |
| Molecular Weight | 430.628 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW17068 |