| SpectraBase Compound ID | 4letjzYWqZu |
|---|---|
| InChI | InChI=1S/C25H42O6/c1-17(2)7-5-8-19-13-21-11-12-23(28-4)24(30-21)15-22(27-3)14-18-9-6-10-20(29-18)16-25(26)31-19/h5,8,17-24H,6-7,9-16H2,1-4H3/b8-5+/t18-,19-,20+,21?,22?,23?,24-/m0/s1 |
| InChIKey | VKXUKYHQFHBKEA-AUIFEKIJSA-N |
| Mol Weight | 438.6 g/mol |
| Molecular Formula | C25H42O6 |
| Exact Mass | 438.298139 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LR1c6HftEUl |
|---|---|
| Name | Leucascandrolide A macrolactone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H42O6 |
| InChI | InChI=1S/C25H42O6/c1-17(2)7-5-8-19-13-21-11-12-23(28-4)24(30-21)15-22(27-3)14-18-9-6-10-20(29-18)16-25(26)31-19/h5,8,17-24H,6-7,9-16H2,1-4H3/b8-5+/t18-,19-,20+,21?,22?,23?,24-/m0/s1 |
| InChIKey | VKXUKYHQFHBKEA-AUIFEKIJSA-N |
| Molecular Weight | 438.605 g/mol |
| SMILES | C1(O[C@](CC2O[C@@](CC(C[C@]3(O[C@@](C1)(CCC3)[H])[H])OC)(C(OC)CC2)[H])(\C=C\CC(C)C)[H])=O |
| SPLASH | splash10-057m-9300000000-63be4434e4be9d313ed5 |
| Source of Spectrum | F-67-5097-2 |
| Wiley ID | 1686765 |