| SpectraBase Compound ID | 3o3aebS2SrO |
|---|---|
| InChI | InChI=1S/C24H26N2O10/c1-32-19(29)24(31)18(28)23-13(27)7-22(24)21(5-6-25(17(21)23)8-12-16(23)36-12)10-3-4-11-15(35-9-34-11)14(10)26(22)20(30)33-2/h3-4,12-13,16-18,27-28,31H,5-9H2,1-2H3/t12-,13-,16-,17+,18+,21+,22-,23+,24+/m0/s1 |
| InChIKey | XMKHYZHGKGQZTD-FFPJCSTLSA-N |
| Mol Weight | 502.48 g/mol |
| Molecular Formula | C24H26N2O10 |
| Exact Mass | 502.158745 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 22a7EIC7njF |
|---|---|
| Name | Kopsimaline D |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H26N2O10 |
| InChI | InChI=1S/C24H26N2O10/c1-32-19(29)24(31)18(28)23-13(27)7-22(24)21(5-6-25(17(21)23)8-12-16(23)36-12)10-3-4-11-15(35-9-34-11)14(10)26(22)20(30)33-2/h3-4,12-13,16-18,27-28,31H,5-9H2,1-2H3/t12-,13-,16-,17+,18+,21+,22-,23+,24+/m0/s1 |
| InChIKey | XMKHYZHGKGQZTD-FFPJCSTLSA-N |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np070401t |
| Molecular Weight | 502.476 g/mol |
| Optical Rotation | [a]D = +83 (c = 0.36, CHCl3) |
| Reported Formula | C24H26N2O10 |
| SMILES | O[C@]1(C[C@@]23[C@@]4([C@@]5([C@]1([C@]([C@@]3(O)C(=O)OC)(O)[H])[C@@]1([C@](CN5CC4)(O1)[H])[H])[H])c1c(N2C(=O)OC)c2c(cc1)OCO2)[H] |
| SPLASH | splash10-0w2i-0018970000-003952cf08bcf856a9ec |
| Source of Spectrum | G4-71-57-4 |
| Wiley ID | 1871960 |