| SpectraBase Compound ID | CItPuc2rdqs |
|---|---|
| InChI | InChI=1S/C27H39NO3/c1-15-11-24(31)25(28-14-15)16(2)19-5-6-20-18-13-23(30)22-12-17(29)7-9-27(22,4)21(18)8-10-26(19,20)3/h11,14,16-22,29,31H,5-10,12-13H2,1-4H3/t16-,17+,18-,19+,20-,21-,22+,26+,27+/m0/s1 |
| InChIKey | NMHCTUTYNGBHMC-FAXYALNOSA-N |
| Mol Weight | 425.6 g/mol |
| Molecular Formula | C27H39NO3 |
| Exact Mass | 425.292994 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Wrp5My30gJ |
|---|---|
| Name | FETISININE;(3R,20S)-3-HYDROXY-20-(5'-HYDROXY-3'-METHYL-PYRIDIN-6'-YL)-5-ALPHA-PREGNAN-6-ONE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H39NO3 |
| InChI | InChI=1S/C27H39NO3/c1-15-11-24(31)25(28-14-15)16(2)19-5-6-20-18-13-23(30)22-12-17(29)7-9-27(22,4)21(18)8-10-26(19,20)3/h11,14,16-22,29,31H,5-10,12-13H2,1-4H3/t16-,17+,18-,19+,20-,21-,22+,26+,27+/m0/s1 |
| InChIKey | NMHCTUTYNGBHMC-FAXYALNOSA-N |
| Literature Reference Author | M.N.AKHTAR,A.U.RAHMAN,M.I.CHOUDHARY,B.SENER,I.ERDOGAN,Y.TSUD A |
| Literature Reference Citation | PHYTOCHEM.,63,115(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00569-1 |
| Molecular Weight | 425.612 g/mol |
| Solvent | CDCl3_OR_CDCl3:CD3OD |
| Source File Reference | UWLU29694 |