| SpectraBase Compound ID | 8buVx4PGxKO |
|---|---|
| InChI | InChI=1S/C22H26O9/c1-10(2)12-5-14-13(9-23)6-15(29-14)18(25)21(4,27)8-16-19-22(31-19,20(26)30-16)17(7-12)28-11(3)24/h6,9,12,16-19,25,27H,1,5,7-8H2,2-4H3/t12-,16-,17+,18+,19-,21-,22?/m0/s1 |
| InChIKey | HDOFLMSTYCZGEX-LAUVXVJJSA-N |
| Mol Weight | 434.44 g/mol |
| Molecular Formula | C22H26O9 |
| Exact Mass | 434.157682 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8DtEt6w8OwK |
|---|---|
| Name | Lophodiol A |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H26O9 |
| InChI | InChI=1S/C22H26O9/c1-10(2)12-5-14-13(9-23)6-15(29-14)18(25)21(4,27)8-16-19-22(31-19,20(26)30-16)17(7-12)28-11(3)24/h6,9,12,16-19,25,27H,1,5,7-8H2,2-4H3/t12-,16-,17+,18+,19-,21-,22?/m0/s1 |
| InChIKey | HDOFLMSTYCZGEX-LAUVXVJJSA-N |
| Molecular Weight | 434.441 g/mol |
| SMILES | O[C@@]1(c2oc(C[C@@](C[C@](C34[C@]([C@](C[C@@]1(O)C)(OC4=O)[H])(O3)[H])(OC(=O)C)[H])(C(=C)C)[H])c(c2)C=O)[H] |
| SPLASH | splash10-000i-0932200000-95bed2a46561d3f06266 |
| Source of Spectrum | G4-69-1753-3 |
| Wiley ID | 1694569 |