| SpectraBase Compound ID | ALk9nHvJo3W |
|---|---|
| InChI | InChI=1S/C37H46O14/c1-18-25(46-19(2)38)16-37(44)32(50-33(43)24-13-11-10-12-14-24)30-35(9,26(47-20(3)39)15-27-36(30,17-45-27)51-23(6)42)31(49-22(5)41)29(48-21(4)40)28(18)34(37,7)8/h10-14,25-27,29-32,44H,15-17H2,1-9H3/t25-,26-,27+,29+,30-,31-,32-,35+,36-,37+/m0/s1 |
| InChIKey | UJFKTEIDORFVQS-SKNQRQHZSA-N |
| Mol Weight | 714.8 g/mol |
| Molecular Formula | C37H46O14 |
| Exact Mass | 714.288756 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ccef7pF28gV |
|---|---|
| Name | BACCATIN-VI |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H46O14 |
| InChI | InChI=1S/C37H46O14/c1-18-25(46-19(2)38)16-37(44)32(50-33(43)24-13-11-10-12-14-24)30-35(9,26(47-20(3)39)15-27-36(30,17-45-27)51-23(6)42)31(49-22(5)41)29(48-21(4)40)28(18)34(37,7)8/h10-14,25-27,29-32,44H,15-17H2,1-9H3/t25-,26-,27+,29+,30-,31-,32-,35+,36-,37+/m0/s1 |
| InChIKey | UJFKTEIDORFVQS-SKNQRQHZSA-N |
| Literature Reference Author | L.BARBONI,P.GARIBOLDI,E.TORREGIANI,G.APPENDINO,G.CRAVOTTO,E. BOMBARDELLI,B.GABETT |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,3233(1994) |
| Literature Reference DOI | 10.1039/p19940003233 |
| Molecular Weight | 714.764 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU4348 |