| SpectraBase Compound ID | 4X8ctgOpgSS |
|---|---|
| InChI | InChI=1S/C18H14O7/c1-9(19)24-8-10-6-12(20)16-14(7-10)25-13-5-3-4-11(18(22)23-2)15(13)17(16)21/h3-7,20H,8H2,1-2H3 |
| InChIKey | HZLNCYGDDJKCMT-UHFFFAOYSA-N |
| Mol Weight | 342.3 g/mol |
| Molecular Formula | C18H14O7 |
| Exact Mass | 342.073953 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BufuIiVbw2i |
|---|---|
| Name | Sydowinin A, ac derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.073952784 u |
| Formula | C18H14O7 |
| InChI | InChI=1S/C18H14O7/c1-9(19)24-8-10-6-12(20)16-14(7-10)25-13-5-3-4-11(18(22)23-2)15(13)17(16)21/h3-7,20H,8H2,1-2H3 |
| InChIKey | HZLNCYGDDJKCMT-UHFFFAOYSA-N |
| Molecular Weight | 342.303 g/mol |
| SMILES | C1(C2=C(C=CC=C2OC2=C1C(=CC(=C2)COC(=O)C)O)C(=O)OC)=O |