| SpectraBase Compound ID | 6a2CJ60dMUD |
|---|---|
| InChI | InChI=1S/C26H36O5/c1-2-16-21(27)17-14-12-10-8-6-4-3-5-7-9-11-13-15-18-23(29)26-24(30)19-22(28)20-25(26)31/h3,5-6,8-9,11-12,14,19-21,27-28,30-31H,2,4,7,10,13,15-18H2,1H3/b5-3-,8-6-,11-9-,14-12- |
| InChIKey | QPQMEUOGTSDCDV-JPURVOHMSA-N |
| Mol Weight | 428.6 g/mol |
| Molecular Formula | C26H36O5 |
| Exact Mass | 428.256274 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CqIalIjFCZU |
|---|---|
| Name | 2-(17'-Hydroxy-1'-oxo-dodeca-tetraenyl)-1,3,5-trihydroxy-benzene |
| CAS Registry Number | 82461-10-7 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C26H36O5 |
| InChI | InChI=1S/C26H36O5/c1-2-16-21(27)17-14-12-10-8-6-4-3-5-7-9-11-13-15-18-23(29)26-24(30)19-22(28)20-25(26)31/h3,5-6,8-9,11-12,14,19-21,27-28,30-31H,2,4,7,10,13,15-18H2,1H3/b5-3-,8-6-,11-9-,14-12- |
| InChIKey | QPQMEUOGTSDCDV-JPURVOHMSA-N |
| Literature Reference | W. Gerwick, W. Fenical, Phytochem. 21, 633 (1982). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |