| SpectraBase Compound ID | DtqUDD8Zags |
|---|---|
| InChI | InChI=1S/C35H44N4O6/c1-9-22-20(5)34(42)38-28(22)15-26-18(3)24(11-13-32(40)44-7)30(36-26)17-31-25(12-14-33(41)45-8)19(4)27(37-31)16-29-23(10-2)21(6)35(43)39-29/h15-16,36-37H,9-14,17H2,1-8H3,(H,38,42)(H,39,43)/b28-15-,29-16- |
| InChIKey | MEFHNFPTBBKFQS-FLZZTMJYSA-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 | EMKQb3i5eA1 |
|---|---|
| Name | MESOBILIRUBIN-XIII-ALPHA-DIMETHYLESTER |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H44N4O6 |
| InChI | InChI=1S/C35H44N4O6/c1-9-22-20(5)34(42)38-28(22)15-26-18(3)24(11-13-32(40)44-7)30(36-26)17-31-25(12-14-33(41)45-8)19(4)27(37-31)16-29-23(10-2)21(6)35(43)39-29/h15-16,36-37H,9-14,17H2,1-8H3,(H,38,42)(H,39,43)/b28-15-,29-16- |
| InChIKey | MEFHNFPTBBKFQS-FLZZTMJYSA-N |
| Literature Reference Author | K.O.HWANG,D.A.LIGHTNER |
| Literature Reference Citation | HETEROCYCLES,37,807(1994) |
| Literature Reference DOI | 10.3987/COM-93-S58 |
| Molecular Weight | 616.758 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWCP2773 |