| SpectraBase Compound ID | 8OqMNqVocFV |
|---|---|
| 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-ZUYNFFDISA-N |
| Mol Weight | 568.6 g/mol |
| Molecular Formula | C28H40O12 |
| Exact Mass | 568.251977 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4A78ORJALrz |
|---|---|
| Name | 7,9-DEACETYL-BACCATIN-IV |
| Compound Number | 3 |
| 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-ZUYNFFDISA-N |
| Literature Reference Author | K.V.RAO,R.S.BHAKUNI,J.B.HANUMAN,R.DAVIES,J.JOHNSON |
| Literature Reference Citation | PHYTOCHEM.,41,863(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00672-9 |
| Molecular Weight | 568.618 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU4092 |