| SpectraBase Compound ID | Ji5NvFkmIdd |
|---|---|
| InChI | InChI=1S/C35H44N4O6/c1-9-22-18(5)34(44)38-26(22)13-24-20(7)32(16(3)11-30(40)41)28(36-24)15-29-33(17(4)12-31(42)43)21(8)25(37-29)14-27-23(10-2)19(6)35(45)39-27/h13-14,16-17,36-37H,9-12,15H2,1-8H3,(H,38,44)(H,39,45)(H,40,41)(H,42,43)/b26-13-,27-14-/t16-,17-/m0/s1 |
| InChIKey | ROULEOGACGZTPH-JMZYIMTPSA-N |
| Mol Weight | 616.8 g/mol |
| Molecular Formula | C35H44N4O6 |
| Exact Mass | 616.326085 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E08ISYeJUyv |
|---|---|
| Name | (BETA-S,BETA'-S)-DIMETHYL-MESO-BILIRUBIN |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H44N4O6 |
| InChI | InChI=1S/C35H44N4O6/c1-9-22-18(5)34(44)38-26(22)13-24-20(7)32(16(3)11-30(40)41)28(36-24)15-29-33(17(4)12-31(42)43)21(8)25(37-29)14-27-23(10-2)19(6)35(45)39-27/h13-14,16-17,36-37H,9-12,15H2,1-8H3,(H,38,44)(H,39,45)(H,40,41)(H,42,43)/b26-13-,27-14-/t16-,17-/m0/s1 |
| InChIKey | ROULEOGACGZTPH-JMZYIMTPSA-N |
| Literature Reference Author | S.E.BOIADJIEV,D.A.LIGHTNER |
| Literature Reference Citation | MH.CHEM.,134,51(2003) |
| Literature Reference DOI | 10.1007/s00706-002-0511-x |
| Molecular Weight | 616.758 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWKP5246 |