| SpectraBase Compound ID | FEFQlXEX3yb |
|---|---|
| InChI | InChI=1S/C23H26O5/c1-17(24)27-22-13-8-19(9-14-22)5-3-4-6-21(26)12-7-20-10-15-23(16-11-20)28-18(2)25/h8-11,13-16H,3-7,12H2,1-2H3 |
| InChIKey | VJZGCABQQBUTJB-UHFFFAOYSA-N |
| Mol Weight | 382.46 g/mol |
| Molecular Formula | C23H26O5 |
| Exact Mass | 382.178024 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gu5LiEpdTAU |
|---|---|
| Name | Acerogenin G diacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 382.178023932 u |
| Formula | C23H26O5 |
| InChI | InChI=1S/C23H26O5/c1-17(24)27-22-13-8-19(9-14-22)5-3-4-6-21(26)12-7-20-10-15-23(16-11-20)28-18(2)25/h8-11,13-16H,3-7,12H2,1-2H3 |
| InChIKey | VJZGCABQQBUTJB-UHFFFAOYSA-N |
| Molecular Weight | 382.456 g/mol |
| SMILES | C1=C(C=CC(=C1)CCC(CCCCC1=CC=C(C=C1)OC(=O)C)=O)OC(=O)C |