| SpectraBase Compound ID | EpYlk1ol4IY |
|---|---|
| InChI | InChI=1S/C20H28O6S/c1-11-14(24-15(21)8-9-27-5)7-6-13-10-19-20(26-19,12(2)16(22)25-19)17(23-4)18(11,13)3/h8-9,11-14,17H,6-7,10H2,1-5H3/b9-8-/t11-,12-,13+,14-,17-,18+,19-,20+/m0/s1 |
| InChIKey | ULNGGZOBSDELFB-ZRQLWAKNSA-N |
| Mol Weight | 396.5 g/mol |
| Molecular Formula | C20H28O6S |
| Exact Mass | 396.16066 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7ex3Y9YBZHi |
|---|---|
| Name | EREMOPETASITENIN-A2 |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H28O6S |
| InChI | InChI=1S/C20H28O6S/c1-11-14(24-15(21)8-9-27-5)7-6-13-10-19-20(26-19,12(2)16(22)25-19)17(23-4)18(11,13)3/h8-9,11-14,17H,6-7,10H2,1-5H3/b9-8-/t11-,12-,13+,14-,17-,18+,19-,20+/m0/s1 |
| InChIKey | ULNGGZOBSDELFB-ZRQLWAKNSA-N |
| Literature Reference Author | M.TORI,M.KAWAHARA,M.SONO |
| Literature Reference Citation | PHYTOCHEM.,47,401(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00581-5 |
| Molecular Weight | 396.499 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS148 |