| SpectraBase Compound ID | Cwil4RkfJPz |
|---|---|
| InChI | InChI=1S/C24H36O7Si/c1-8-15(2)23(26)31-22-20-16(3)24(27)30-19(20)12-17(14-29-32(5,6)7)10-9-11-18(13-25)21(22)28-4/h11-13,15,19-22H,3,8-10,14H2,1-2,4-7H3/b17-12-,18-11-/t15?,19-,20+,21+,22+/m1/s1 |
| InChIKey | XGSGZFHFNZPMOY-DNOZUERHSA-N |
| Mol Weight | 464.6 g/mol |
| Molecular Formula | C24H36O7Si |
| Exact Mass | 464.22303 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GKgggvfhQqP |
|---|---|
| Name | Lecocarpinolide J, tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 464.223030027 u |
| Formula | C24H36O7Si |
| InChI | InChI=1S/C24H36O7Si/c1-8-15(2)23(26)31-22-20-16(3)24(27)30-19(20)12-17(14-29-32(5,6)7)10-9-11-18(13-25)21(22)28-4/h11-13,15,19-22H,3,8-10,14H2,1-2,4-7H3/b17-12-,18-11-/t15?,19-,20+,21+,22+/m1/s1 |
| InChIKey | XGSGZFHFNZPMOY-DNOZUERHSA-N |
| Molecular Weight | 464.630 g/mol |
| SMILES | C(C(CC)C)(=O)O[C@@]1([C@](\C(=C/CC\C(=C\[C@]2(OC(=O)C([C@]12[H])=C)[H])CO[Si](C)(C)C)C=O)(OC)[H])[H] |