| SpectraBase Compound ID | 3veoG09BDW8 |
|---|---|
| InChI | InChI=1S/C28H24O12/c1-38-28(37)25(14-17-3-7-19(30)21(32)12-17)39-23-8-4-15(10-22(23)33)5-9-26(34)40-24(27(35)36)13-16-2-6-18(29)20(31)11-16/h2-12,14,24,29-33H,13H2,1H3,(H,35,36)/b9-5+,25-14+ |
| InChIKey | JRSJLGASDWZQGF-PIXWBHQNSA-N |
| Mol Weight | 552.49 g/mol |
| Molecular Formula | C28H24O12 |
| Exact Mass | 552.126776 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FxjkRn5XiZt |
|---|---|
| Name | METHYL-MELITRATE-A |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H24O12 |
| InChI | InChI=1S/C28H24O12/c1-38-28(37)25(14-17-3-7-19(30)21(32)12-17)39-23-8-4-15(10-22(23)33)5-9-26(34)40-24(27(35)36)13-16-2-6-18(29)20(31)11-16/h2-12,14,24,29-33H,13H2,1H3,(H,35,36)/b9-5+,25-14+ |
| InChIKey | JRSJLGASDWZQGF-PIXWBHQNSA-N |
| Literature Reference Author | Y.LU,L.Y.FOO,H.WONG |
| Literature Reference Citation | PHYTOCHEM.,52,1149(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00368-4 |
| Molecular Weight | 552.491 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN384 |