| SpectraBase Compound ID | 2yi4foI5CJt |
|---|---|
| InChI | InChI=1S/C30H34Br3N3O5/c1-36(2)12-7-13-40-29-24(32)16-22(17-25(29)33)27(37)18-34-30(38)26(35-41-19-20-8-5-4-6-9-20)15-21-10-11-28(39-3)23(31)14-21/h4-6,8-11,14,16-17,27,37H,7,12-13,15,18-19H2,1-3H3,(H,34,38)/b35-26+ |
| InChIKey | CXJKHXHDQQHCAI-MDAYZVFASA-N |
| Mol Weight | 756.3 g/mol |
| Molecular Formula | C30H34Br3N3O5 |
| Exact Mass | 753.00486 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E7iXdvulSfi |
|---|---|
| Name | CXJKHXHDQQHCAI-MDAYZVFASA-N |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H34Br3N3O5 |
| InChI | InChI=1S/C30H34Br3N3O5/c1-36(2)12-7-13-40-29-24(32)16-22(17-25(29)33)27(37)18-34-30(38)26(35-41-19-20-8-5-4-6-9-20)15-21-10-11-28(39-3)23(31)14-21/h4-6,8-11,14,16-17,27,37H,7,12-13,15,18-19H2,1-3H3,(H,34,38)/b35-26+ |
| InChIKey | CXJKHXHDQQHCAI-MDAYZVFASA-N |
| Literature Reference Author | T.D.TRAN,N.B.PHAM,G.FECHNER,J.N.A.HOOPER,R.J.QUINN |
| Literature Reference Citation | J.NAT.PROD.,76,516(2013) |
| Literature Reference DOI | 10.1021/np300648d |
| Molecular Weight | 756.329 g/mol |
| Sample ID | 42328 |
| Solvent | DMSO-D6 |