| SpectraBase Compound ID | 8ekljDasA8E |
|---|---|
| InChI | InChI=1S/C22H22Br2N10O2/c23-11-7-15(29-9-11)19(35)27-5-1-3-13-17(33-21(25)31-13)18-14(32-22(26)34-18)4-2-6-28-20(36)16-8-12(24)10-30-16/h1-4,7-10,29-30H,5-6H2,(H,27,35)(H,28,36)(H3,25,31,33)(H3,26,32,34)/b3-1+,4-2+ |
| InChIKey | NONRPUUUJKRMOY-ZPUQHVIOSA-N |
| Mol Weight | 618.29 g/mol |
| Molecular Formula | C22H22Br2N10O2 |
| Exact Mass | 616.029396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B2LHfd0NoSS |
|---|---|
| Name | NAGELAMIDE-I |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H22Br2N10O2 |
| InChI | InChI=1S/C22H22Br2N10O2/c23-11-7-15(29-9-11)19(35)27-5-1-3-13-17(33-21(25)31-13)18-14(32-22(26)34-18)4-2-6-28-20(36)16-8-12(24)10-30-16/h1-4,7-10,29-30H,5-6H2,(H,27,35)(H,28,36)(H3,25,31,33)(H3,26,32,34)/b3-1+,4-2+ |
| InChIKey | NONRPUUUJKRMOY-ZPUQHVIOSA-N |
| Literature Reference Author | T.IWAI,T.KUBOTA,J.FROMONT,J.KOBAYASHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,62,213(2014) |
| Literature Reference DOI | 10.1248/cpb.c13-00821 |
| Molecular Weight | 618.290 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWBT13831 |