| SpectraBase Compound ID | 4muGsagNEAX |
|---|---|
| InChI | InChI=1S/C24H30N2O7/c1-31-14-5-6-16-15(13-14)22-10-12-25-11-4-7-21(17(22)25)8-9-23(22,26(16)20(29)33-3)24(30,18(21)27)19(28)32-2/h5-6,13,17-18,27,30H,4,7-12H2,1-3H3/t17-,18-,21-,22+,23-,24+/m0/s1 |
| InChIKey | PJDRFJGYWGPIGZ-RDVCTWCYSA-N |
| Mol Weight | 458.51 g/mol |
| Molecular Formula | C24H30N2O7 |
| Exact Mass | 458.205301 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 55knX3i9sXX |
|---|---|
| Name | Kopsiloscine D |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H30N2O7 |
| InChI | InChI=1S/C24H30N2O7/c1-31-14-5-6-16-15(13-14)22-10-12-25-11-4-7-21(17(22)25)8-9-23(22,26(16)20(29)33-3)24(30,18(21)27)19(28)32-2/h5-6,13,17-18,27,30H,4,7-12H2,1-3H3/t17-,18-,21-,22+,23-,24+/m0/s1 |
| InChIKey | PJDRFJGYWGPIGZ-RDVCTWCYSA-N |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np0703747 |
| Molecular Weight | 458.511 g/mol |
| Optical Rotation | [a]D = -63 (c = 0.10, CHCl3) |
| Reported Formula | C24H30N2O7 |
| SMILES | O[C@@]1([C@]23[C@@]4([C@@]5([C@@]([C@@]1(O)[H])(CC3)CCCN5CC4)[H])c1c(N2C(OC)=O)ccc(c1)OC)C(OC)=O |
| SPLASH | splash10-0a4i-0034900000-66f082e2527f27b3243f |
| Source of Spectrum | G4-70-1788-5 |
| Wiley ID | 1874351 |