| SpectraBase Compound ID | 4anWKGaxXvu |
|---|---|
| InChI | InChI=1S/C21H24Br3N3O5/c1-30-18-14(23)10-21(19(28)17(18)24)11-15(27-32-21)20(29)26-7-2-8-31-16-4-3-12(5-6-25)9-13(16)22/h3-4,9-10,19,28H,2,5-8,11,25H2,1H3,(H,26,29)/t19-,21+/m0/s1 |
| InChIKey | NMQGCYQSHLBLKC-PZJWPPBQSA-N |
| Mol Weight | 638.15 g/mol |
| Molecular Formula | C21H24Br3N3O5 |
| Exact Mass | 634.92661 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ElpqvVdosDF |
|---|---|
| Name | 14-DEBROMOARAPLYSILLIN-1 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H24Br3N3O5 |
| InChI | InChI=1S/C21H24Br3N3O5/c1-30-18-14(23)10-21(19(28)17(18)24)11-15(27-32-21)20(29)26-7-2-8-31-16-4-3-12(5-6-25)9-13(16)22/h3-4,9-10,19,28H,2,5-8,11,25H2,1H3,(H,26,29)/t19-,21+/m0/s1 |
| InChIKey | NMQGCYQSHLBLKC-PZJWPPBQSA-N |
| Literature Reference Author | D.M.JAMES,H.B.KUNZE,D.J.FAULKNER |
| Literature Reference Citation | J.NAT.PROD.,54,1137(1991) |
| Literature Reference DOI | 10.1021/np50076a040 |
| Molecular Weight | 638.151 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS5114 |