| SpectraBase Compound ID | 9wFpE4s7OlI |
|---|---|
| InChI | InChI=1S/C37H66O7/c1-3-4-5-6-7-8-9-13-16-19-22-33(40)35-25-26-36(44-35)34(41)28-32(39)21-18-15-12-10-11-14-17-20-31(38)24-23-30-27-29(2)43-37(30)42/h27,29,32-36,39-41H,3-26,28H2,1-2H3/t29-,32?,33-,34-,35-,36-/m1/s1 |
| InChIKey | ZGJBROCWEAASGS-DUTIPKBZSA-N |
| Mol Weight | 622.9 g/mol |
| Molecular Formula | C37H66O7 |
| Exact Mass | 622.480854 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HLO1lEk9S2i |
|---|---|
| Name | TONKININ-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H66O7 |
| InChI | InChI=1S/C37H66O7/c1-3-4-5-6-7-8-9-13-16-19-22-33(40)35-25-26-36(44-35)34(41)28-32(39)21-18-15-12-10-11-14-17-20-31(38)24-23-30-27-29(2)43-37(30)42/h27,29,32-36,39-41H,3-26,28H2,1-2H3/t29-,32?,33-,34-,35-,36-/m1/s1 |
| InChIKey | ZGJBROCWEAASGS-DUTIPKBZSA-N |
| Literature Reference Author | Y.CHEN,R.Y.CHEN,D.Q.YU |
| Literature Reference Citation | PHYTOCHEM.,43,793(1996) |
| Literature Reference DOI | 10.1016/0031-9422(96)00377-9 |
| Molecular Weight | 622.927 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS2179 |