| SpectraBase Compound ID | EZtMfRUcJy |
|---|---|
| InChI | InChI=1S/C33H40N4O6/c1-7-20-18(5)32(42)36-26(20)13-24-16(3)22(9-11-30(38)39)28(34-24)15-29-23(10-12-31(40)41)17(4)25(35-29)14-27-21(8-2)19(6)33(43)37-27/h13-14,34-35H,7-12,15H2,1-6H3,(H,36,42)(H,37,43)(H,38,39)(H,40,41)/b26-13-,27-14- |
| InChIKey | PSUYEWBLPHMDMK-IFADSCNNSA-N |
| Mol Weight | 588.7 g/mol |
| Molecular Formula | C33H40N4O6 |
| Exact Mass | 588.294785 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D8M2mZ1USzs |
|---|---|
| Name | 2,7-DIMETHYL-3-ETHYL-(10H)-DIPYRRIN-1-ONE-8-PROPIONIC-ACID;NEOXANTHO-BILIRUBIC-ACID |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H40N4O6 |
| InChI | InChI=1S/C33H40N4O6/c1-7-20-18(5)32(42)36-26(20)13-24-16(3)22(9-11-30(38)39)28(34-24)15-29-23(10-12-31(40)41)17(4)25(35-29)14-27-21(8-2)19(6)33(43)37-27/h13-14,34-35H,7-12,15H2,1-6H3,(H,36,42)(H,37,43)(H,38,39)(H,40,41)/b26-13-,27-14- |
| InChIKey | PSUYEWBLPHMDMK-IFADSCNNSA-N |
| Literature Reference Author | B.GHOSH,D.A.LIGHTNER |
| Literature Reference Citation | J.HETCYCL.CHEM.,40,1113(2003) |
| Literature Reference DOI | 10.1002/jhet.5570400624 |
| Molecular Weight | 588.704 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMS22969 |