| SpectraBase Compound ID | 2vMNma7qQHf |
|---|---|
| InChI | InChI=1S/C26H34O6/c1-16(27)31-22-11-12-25(4)20(24(22,2)3)10-13-26(5,29)21(25)15-30-18-8-6-17-7-9-23(28)32-19(17)14-18/h6-9,14,20-22,29H,10-13,15H2,1-5H3/t20?,21-,22+,25+,26+/m1/s1 |
| InChIKey | RIPKCRCUFJSKKD-RZIWSFRDSA-N |
| Mol Weight | 442.6 g/mol |
| Molecular Formula | C26H34O6 |
| Exact Mass | 442.235539 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8sC9tqTY13J |
|---|---|
| Name | 3-O-ACETYL-EPISAMARCANDIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H34O6 |
| InChI | InChI=1S/C26H34O6/c1-16(27)31-22-11-12-25(4)20(24(22,2)3)10-13-26(5,29)21(25)15-30-18-8-6-17-7-9-23(28)32-19(17)14-18/h6-9,14,20-22,29H,10-13,15H2,1-5H3/t20?,21-,22+,25+,26+/m1/s1 |
| InChIKey | RIPKCRCUFJSKKD-RZIWSFRDSA-N |
| Literature Reference Author | M.I.NASSAR,T.K.MOHAMED |
| Literature Reference Citation | FITOTERAPIA,69,41(1998) |
| Molecular Weight | 442.552 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ9202 |