| SpectraBase Compound ID | 2EMvfpywVn0 |
|---|---|
| InChI | InChI=1S/C21H30O6/c1-7-11(2)18(23)26-17-16-12(3)19(24)27-21(16,25-6)10-14-8-9-15(22)13(4)20(14,17)5/h7,13-15,17,22H,8-10H2,1-6H3/b11-7-/t13-,14+,15-,17+,20+,21-/m0/s1 |
| InChIKey | BMPRGPGLZWJNOP-CNIMQSSCSA-N |
| Mol Weight | 378.47 g/mol |
| Molecular Formula | C21H30O6 |
| Exact Mass | 378.204239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5xAvEJM9yms |
|---|---|
| Name | EREMOPETASITENIN-D1 |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H30O6 |
| InChI | InChI=1S/C21H30O6/c1-7-11(2)18(23)26-17-16-12(3)19(24)27-21(16,25-6)10-14-8-9-15(22)13(4)20(14,17)5/h7,13-15,17,22H,8-10H2,1-6H3/b11-7-/t13-,14+,15-,17+,20+,21-/m0/s1 |
| InChIKey | BMPRGPGLZWJNOP-CNIMQSSCSA-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 | 378.466 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS144 |