| SpectraBase Compound ID | 127y0GWsM7C |
|---|---|
| InChI | InChI=1S/C24H38O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-15-17-22(27-20)23-18-16-21(28-29-23)19-24(25)26/h2,5-8,20-23H,1,3-4,9-19H2,(H,25,26)/b6-5+,8-7+/t20?,21-,22-,23?/m0/s1 |
| InChIKey | AAJUINQOJSADQB-UGVRNAEASA-N |
| Mol Weight | 406.6 g/mol |
| Molecular Formula | C24H38O5 |
| Exact Mass | 406.271924 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LF2LdqEjGFY |
|---|---|
| Name | Stolonoxides A/B |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 406.271924319 u |
| Formula | C24H38O5 |
| InChI | InChI=1S/C24H38O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-15-17-22(27-20)23-18-16-21(28-29-23)19-24(25)26/h2,5-8,20-23H,1,3-4,9-19H2,(H,25,26)/b6-5+,8-7+/t20?,21-,22-,23?/m0/s1 |
| InChIKey | AAJUINQOJSADQB-UGVRNAEASA-N |
| Molecular Weight | 406.563 g/mol |
| SMILES | C1(OO[C@@](CC1)(CC(=O)O)[H])[C@]1(OC(CCCCCC\C=C\C=C\CCC=C)CC1)[H] |