| SpectraBase Compound ID | 1w3HJvbb7k0 |
|---|---|
| InChI | InChI=1S/C22H28O8/c1-10(23)27-13-6-5-12-19(26)28-15-9-21(3)20(2,17(13)22(12,15)4)8-14(30-21)11-7-16(24)29-18(11)25/h7,12-17,24H,5-6,8-9H2,1-4H3/t12-,13-,14-,15-,16?,17+,20+,21-,22-/m0/s1 |
| InChIKey | XKMCNVXHYXBDFO-BFGBFILCSA-N |
| Mol Weight | 420.46 g/mol |
| Molecular Formula | C22H28O8 |
| Exact Mass | 420.178418 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IwblYmy9qkL |
|---|---|
| Name | 1-ALPHA-ACETOXY-8-BETA,12-EPOXY-15-HYDROXY-CIS-ENT-CLERODA-13-EN-16,15:18-ALPHA,6-ALPHA-DIOLIDE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H28O8 |
| InChI | InChI=1S/C22H28O8/c1-10(23)27-13-6-5-12-19(26)28-15-9-21(3)20(2,17(13)22(12,15)4)8-14(30-21)11-7-16(24)29-18(11)25/h7,12-17,24H,5-6,8-9H2,1-4H3/t12-,13-,14-,15-,16?,17+,20+,21-,22-/m0/s1 |
| InChIKey | XKMCNVXHYXBDFO-BFGBFILCSA-N |
| Literature Reference Author | B.BLAES,J.ZAPP,H.BECKER |
| Literature Reference Citation | PHYTOCHEM.,65,127(2004) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00387-X |
| Molecular Weight | 420.460 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU34566 |