| SpectraBase Compound ID | BvNndef4wOY |
|---|---|
| InChI | InChI=1S/C24H36O5/c1-15-8-7-9-20-23(15,5)12-10-16(2)24(20,6)13-11-19-14-21(27-17(3)25)29-22(19)28-18(4)26/h11,16,20-22H,1,7-10,12-14H2,2-6H3/b19-11-/t16-,20+,21?,22?,23+,24+/m1/s1 |
| InChIKey | DQENVRIDXFEYAZ-UEDHELBHSA-N |
| Mol Weight | 404.5 g/mol |
| Molecular Formula | C24H36O5 |
| Exact Mass | 404.256274 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FFrggt9KUmf |
|---|---|
| Name | 15,16-Diacetoxy-15,16-epoxy-ent-cleroda-4(18),12Z-diene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 404.256274254 u |
| Formula | C24H36O5 |
| InChI | InChI=1S/C24H36O5/c1-15-8-7-9-20-23(15,5)12-10-16(2)24(20,6)13-11-19-14-21(27-17(3)25)29-22(19)28-18(4)26/h11,16,20-22H,1,7-10,12-14H2,2-6H3/b19-11-/t16-,20+,21?,22?,23+,24+/m1/s1 |
| InChIKey | DQENVRIDXFEYAZ-UEDHELBHSA-N |
| Molecular Weight | 404.547 g/mol |
| SMILES | [C@@]12([C@@]([C@](C\C=C/3C(OC(C3)OC(=O)C)OC(=O)C)(C)[C@@](CC1)(C)[H])(CCCC2=C)[H])C |