| SpectraBase Compound ID | Ke8qzVRCLX6 |
|---|---|
| InChI | InChI=1S/C21H32O3/c1-4-14-17(22)10-16-13-6-5-12-9-18(23)19(24)11-21(12,3)15(13)7-8-20(14,16)2/h4,12-13,15-16,18-19,23-24H,5-11H2,1-3H3/b14-4-/t12-,13+,15?,16?,18+,19-,20+,21-/m0/s1 |
| InChIKey | SNBODTQYFCSFKC-XBWBUSDHSA-N |
| Mol Weight | 332.5 g/mol |
| Molecular Formula | C21H32O3 |
| Exact Mass | 332.235145 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Y9PpfiAomW |
|---|---|
| Name | 2-BETA,3-BETA-DIHYDROXY-5-ALPHA-PREGN-17(20)-(E)-EN-16-ONE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32O3 |
| InChI | InChI=1S/C21H32O3/c1-4-14-17(22)10-16-13-6-5-12-9-18(23)19(24)11-21(12,3)15(13)7-8-20(14,16)2/h4,12-13,15-16,18-19,23-24H,5-11H2,1-3H3/b14-4-/t12-,13+,15?,16?,18+,19-,20+,21-/m0/s1 |
| InChIKey | SNBODTQYFCSFKC-XBWBUSDHSA-N |
| Literature Reference Author | A.INADA,H.MURATA,Y.INATOMI,T.NAKANISHI,D.DARNAEDI |
| Literature Reference Citation | PHYTOCHEM.,45,1225(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00145-3 |
| Molecular Weight | 332.483 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSP510 |