| SpectraBase Compound ID | 3V4TvW3HIB4 |
|---|---|
| InChI | InChI=1S/C36H38N2O6/c1-38-12-10-23-18-33(43-4)35(40)36-34(23)28(38)16-21-6-8-30(41-2)26(14-21)25-13-20(5-7-29(25)39)15-27-24-19-32(44-36)31(42-3)17-22(24)9-11-37-27/h5-8,13-14,17-19,27-28,37,39-40H,9-12,15-16H2,1-4H3/t27-,28+/m1/s1 |
| InChIKey | IXKWJOUSNXVCKD-IZLXSDGUSA-N |
| Mol Weight | 594.7 g/mol |
| Molecular Formula | C36H38N2O6 |
| Exact Mass | 594.272987 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EWkBsRvtFy0 |
|---|---|
| Name | TILITRIANDRINE |
| Compound Number | 387 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H38N2O6 |
| InChI | InChI=1S/C36H38N2O6/c1-38-12-10-23-18-33(43-4)35(40)36-34(23)28(38)16-21-6-8-30(41-2)26(14-21)25-13-20(5-7-29(25)39)15-27-24-19-32(44-36)31(42-3)17-22(24)9-11-37-27/h5-8,13-14,17-19,27-28,37,39-40H,9-12,15-16H2,1-4H3/t27-,28+/m1/s1 |
| InChIKey | IXKWJOUSNXVCKD-IZLXSDGUSA-N |
| Literature Reference Author | P.L.SCHIFF |
| Literature Reference Citation | J.NAT.PROD.,54,645(1991) |
| Literature Reference DOI | 10.1021/np50075a001 |
| Molecular Weight | 594.708 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWPR2009 |