| SpectraBase Compound ID | d2sltSjH1S |
|---|---|
| InChI | InChI=1S/C43H60O6/c1-30-13-19-42(5)34(9-7-11-36(42)40(30,3)21-15-32-17-23-46-26-32)28-48-38(44)25-39(45)49-29-35-10-8-12-37-41(4,22-16-33-18-24-47-27-33)31(2)14-20-43(35,37)6/h9-10,17-18,23-24,26-27,30-31,36-37H,7-8,11-16,19-22,25,28-29H2,1-6H3/t30-,31-,36-,37-,40+,41+,42+,43+/m1/s1 |
| InChIKey | FIPQABDDQPFCOV-NOUCKNKTSA-N |
| Mol Weight | 672.9 g/mol |
| Molecular Formula | C43H60O6 |
| Exact Mass | 672.43899 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Kp77xDIM09 |
|---|---|
| Name | BACCHALEJIN-1 |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H60O6 |
| InChI | InChI=1S/C43H60O6/c1-30-13-19-42(5)34(9-7-11-36(42)40(30,3)21-15-32-17-23-46-26-32)28-48-38(44)25-39(45)49-29-35-10-8-12-37-41(4,22-16-33-18-24-47-27-33)31(2)14-20-43(35,37)6/h9-10,17-18,23-24,26-27,30-31,36-37H,7-8,11-16,19-22,25,28-29H2,1-6H3/t30-,31-,36-,37-,40+,41+,42+,43+/m1/s1 |
| InChIKey | FIPQABDDQPFCOV-NOUCKNKTSA-N |
| Literature Reference Author | C.LABBE,M.CASTILLO,M.HERNANDEZ |
| Literature Reference Citation | PHYTOCHEM.,30,1607(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)84217-G |
| Molecular Weight | 672.946 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS26094 |