| SpectraBase Compound ID | J6KZYk8eBgx |
|---|---|
| InChI | InChI=1S/C40H49N3O6/c1-4-26(20-27-16-18-30-24(2)15-17-32(30)37(27)39(47)34-14-9-19-41-34)38(46)25(3)10-5-6-11-29(44)22-36(45)43-35(40(48)49)21-28-23-42-33-13-8-7-12-31(28)33/h5-10,12-14,16,18-20,23-24,27,29-30,32,35,37-38,41-42,44,46H,4,11,15,17,21-22H2,1-3H3,(H,43,45)(H,48,49)/b6-5-,25-10+,26-20+ |
| InChIKey | SXROOCSLGHPGOI-UHHUNHFOSA-N |
| Mol Weight | 667.8 g/mol |
| Molecular Formula | C40H49N3O6 |
| Exact Mass | 667.362136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7IMc4ghBjn8 |
|---|---|
| Name | JBIR-11 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H49N3O6 |
| InChI | InChI=1S/C40H49N3O6/c1-4-26(20-27-16-18-30-24(2)15-17-32(30)37(27)39(47)34-14-9-19-41-34)38(46)25(3)10-5-6-11-29(44)22-36(45)43-35(40(48)49)21-28-23-42-33-13-8-7-12-31(28)33/h5-10,12-14,16,18-20,23-24,27,29-30,32,35,37-38,41-42,44,46H,4,11,15,17,21-22H2,1-3H3,(H,43,45)(H,48,49)/b6-5-,25-10+,26-20+ |
| InChIKey | SXROOCSLGHPGOI-UHHUNHFOSA-N |
| Literature Reference Author | M.IZUMIKAWA,H.KOMAKI,J.HASHIMOTO,M.TAKAGI,K.SHIN-YA |
| Literature Reference Citation | J.ANTIBIOTICS,61,326(2008) |
| Literature Reference DOI | 10.1038/ja.2008.47 |
| Molecular Weight | 667.846 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMB336 |