| SpectraBase Compound ID | NQ6vjdZ9xQ |
|---|---|
| InChI | InChI=1S/C24H39NO7/c1-5-25-10-21(11-30-2)7-6-15(32-4)23-13-8-12-14(31-3)9-22(28,16(13)17(12)26)24(29,20(23)25)19(27)18(21)23/h12-20,26-29H,5-11H2,1-4H3/t12?,13?,14-,15-,16?,17-,18?,19+,20?,21-,22+,23-,24?/m0/s1 |
| InChIKey | STJFGOITBNKPSO-SSHKFUDVSA-N |
| Mol Weight | 453.6 g/mol |
| Molecular Formula | C24H39NO7 |
| Exact Mass | 453.272653 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IzBlvStudZb |
|---|---|
| Name | VAGINATINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H39NO7 |
| InChI | InChI=1S/C24H39NO7/c1-5-25-10-21(11-30-2)7-6-15(32-4)23-13-8-12-14(31-3)9-22(28,16(13)17(12)26)24(29,20(23)25)19(27)18(21)23/h12-20,26-29H,5-11H2,1-4H3/t12?,13?,14-,15-,16?,17-,18?,19+,20?,21-,22+,23-,24?/m0/s1 |
| InChIKey | STJFGOITBNKPSO-SSHKFUDVSA-N |
| Literature Reference Author | Q.P.JIANG,W.L.SUNG |
| Literature Reference Citation | HETEROCYCLES,24,877(1986) |
| Literature Reference DOI | 10.3987/R-1986-04-0877 |
| Molecular Weight | 453.576 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED14192 |