| SpectraBase Compound ID | FIbNij5PotA |
|---|---|
| InChI | InChI=1S/C32H44N6O13/c33-13-3-1-9-19(35-27(44)17-7-5-11-23(40)25(17)42)29(46)37-21(15-39)32(50)51-16-22(31(48)49)38-30(47)20(10-2-4-14-34)36-28(45)18-8-6-12-24(41)26(18)43/h5-8,11-12,19-22,39-43H,1-4,9-10,13-16,33-34H2,(H,35,44)(H,36,45)(H,37,46)(H,38,47)(H,48,49)/t19-,20+,21-,22-/m0/s1 |
| InChIKey | NQNOYRJMWKVMTO-LRSLUSHPSA-N |
| Mol Weight | 720.7 g/mol |
| Molecular Formula | C32H44N6O13 |
| Exact Mass | 720.296635 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EVtJttbgM1k |
|---|---|
| Name | DICHRYSOBACTIN |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H44N6O13 |
| InChI | InChI=1S/C32H44N6O13/c33-13-3-1-9-19(35-27(44)17-7-5-11-23(40)25(17)42)29(46)37-21(15-39)32(50)51-16-22(31(48)49)38-30(47)20(10-2-4-14-34)36-28(45)18-8-6-12-24(41)26(18)43/h5-8,11-12,19-22,39-43H,1-4,9-10,13-16,33-34H2,(H,35,44)(H,36,45)(H,37,46)(H,38,47)(H,48,49)/t19-,20+,21-,22-/m0/s1 |
| InChIKey | NQNOYRJMWKVMTO-LRSLUSHPSA-N |
| Literature Reference Author | M.SANDY,A.BUTLER |
| Literature Reference Citation | J.NAT.PROD.,74,1207(2011) |
| Literature Reference DOI | 10.1021/np200126z |
| Molecular Weight | 720.734 g/mol |
| Sample ID | 38228 |
| Solvent | CD3OD |