| SpectraBase Compound ID | EmH6DvgDpU6 |
|---|---|
| InChI | InChI=1S/C36H34N2O9/c1-45-30-19-24(8-13-28(30)41)34-33(36(44)38-20-29(42)23-6-11-26(40)12-7-23)27-17-22(18-31(46-2)35(27)47-34)5-14-32(43)37-16-15-21-3-9-25(39)10-4-21/h3-14,17-19,33-34,39-41H,15-16,20H2,1-2H3,(H,37,43)(H,38,44)/b14-5+/t33-,34-/m0/s1 |
| InChIKey | XVJJOSGFWYDEBL-HLCHFAOESA-N |
| Mol Weight | 638.7 g/mol |
| Molecular Formula | C36H34N2O9 |
| Exact Mass | 638.226431 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KgmgMV3ppxS |
|---|---|
| Name | TRIBULUSAMIDE_B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H34N2O9 |
| InChI | InChI=1S/C36H34N2O9/c1-45-30-19-24(8-13-28(30)41)34-33(36(44)38-20-29(42)23-6-11-26(40)12-7-23)27-17-22(18-31(46-2)35(27)47-34)5-14-32(43)37-16-15-21-3-9-25(39)10-4-21/h3-14,17-19,33-34,39-41H,15-16,20H2,1-2H3,(H,37,43)(H,38,44)/b14-5+/t33-,34-/m0/s1 |
| InChIKey | XVJJOSGFWYDEBL-HLCHFAOESA-N |
| Literature Reference Author | J.-X.LI,Q.SHI,Q.-B.XIONG,J.K.PRASAIN,Y.TEZUKA,T.HAREYAMA,Z.- T.WANG,K.TANAKA |
| Literature Reference Citation | PLANTA.MED.,64,628(1998) |
| Literature Reference DOI | 10.1055/s-2006-957535 |
| Molecular Weight | 638.674 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UIAP1175 |