| SpectraBase Compound ID | 29SbJnvGVE6 |
|---|---|
| InChI | InChI=1S/C28H40O12/c1-12-17(37-13(2)29)10-28(35)24(39-15(4)31)22-26(8,18(33)9-19-27(22,11-36-19)40-16(5)32)23(34)21(38-14(3)30)20(12)25(28,6)7/h17-19,21-24,33-35H,9-11H2,1-8H3/t17-,18-,19+,21+,22-,23-,24-,26+,27-,28+/m0/s1 |
| InChIKey | LIFLKOJGJVAOKK-XZYLXXQVSA-N |
| Mol Weight | 568.6 g/mol |
| Molecular Formula | C28H40O12 |
| Exact Mass | 568.251977 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LbEhGnf5IFY |
|---|---|
| Name | 7,9-DEACETYLBACCATIN-4 |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40O12 |
| InChI | InChI=1S/C28H40O12/c1-12-17(37-13(2)29)10-28(35)24(39-15(4)31)22-26(8,18(33)9-19-27(22,11-36-19)40-16(5)32)23(34)21(38-14(3)30)20(12)25(28,6)7/h17-19,21-24,33-35H,9-11H2,1-8H3/t17-,18-,19+,21+,22-,23-,24-,26+,27-,28+/m0/s1 |
| InChIKey | LIFLKOJGJVAOKK-XZYLXXQVSA-N |
| Literature Reference Author | L.O.ZAMIR,M.E.NEDEA,Z.H.ZHOU,S.BELAIR,G.CARON,F.SAURIOL,E.JA CQMAIN,F.I.JEAN,F.X. |
| Literature Reference Citation | CAN.J.CHEM.,73,655(1995) |
| Literature Reference DOI | 10.1139/v95-084 |
| Molecular Weight | 568.618 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS15858 |