| SpectraBase Compound ID | 786kS3h7iil |
|---|---|
| InChI | InChI=1S/C39H70O8/c1-4-5-6-7-8-9-10-14-17-20-23-35(43)36-26-27-37(47-36)38(46-31(3)40)29-34(42)22-19-16-13-11-12-15-18-21-33(41)25-24-32-28-30(2)45-39(32)44/h28,30,33-38,41-43H,4-27,29H2,1-3H3/t30-,33?,34?,35+,36-,37-,38+/m1/s1 |
| InChIKey | BIODFBOSASJNMO-JXUJFMQZSA-N |
| Mol Weight | 667.0 g/mol |
| Molecular Formula | C39H70O8 |
| Exact Mass | 666.507069 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1YBR58fUCOO |
|---|---|
| Name | TONKINESIN-C |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H70O8 |
| InChI | InChI=1S/C39H70O8/c1-4-5-6-7-8-9-10-14-17-20-23-35(43)36-26-27-37(47-36)38(46-31(3)40)29-34(42)22-19-16-13-11-12-15-18-21-33(41)25-24-32-28-30(2)45-39(32)44/h28,30,33-38,41-43H,4-27,29H2,1-3H3/t30-,33?,34?,35+,36-,37-,38+/m1/s1 |
| InChIKey | BIODFBOSASJNMO-JXUJFMQZSA-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 | 666.980 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS2183 |