| SpectraBase Compound ID | 4lFO6cHBNTq |
|---|---|
| InChI | InChI=1S/C23H38O9/c1-8-9-10-17(25)11-12-18(26)32-19-13(2)20(29-7)23(6,28)21(31-16(5)24)14(3)22(27)30-15(19)4/h11-15,17,19-21,25,28H,8-10H2,1-7H3/b12-11+/t13-,14-,15+,17?,19-,20+,21-,23-/m1/s1 |
| InChIKey | AOCQSDGADDMNAL-QVSUEHLGSA-N |
| Mol Weight | 458.5 g/mol |
| Molecular Formula | C23H38O9 |
| Exact Mass | 458.251583 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 | 50IecfhpkIQ |
|---|---|
| Name | 3-O-ACETYL-5-O-METHYL-BOTCINOLIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H38O9 |
| InChI | InChI=1S/C23H38O9/c1-8-9-10-17(25)11-12-18(26)32-19-13(2)20(29-7)23(6,28)21(31-16(5)24)14(3)22(27)30-15(19)4/h11-15,17,19-21,25,28H,8-10H2,1-7H3/b12-11+/t13-,14-,15+,17?,19-,20+,21-,23-/m1/s1 |
| InChIKey | AOCQSDGADDMNAL-QVSUEHLGSA-N |
| Literature Reference Author | I.G.COLLADO,J.ALEU,R.HERNANDEZ-GALAN,J.R.HANSON |
| Literature Reference Citation | PHYTOCHEM.,42,1621(1996) |
| Literature Reference DOI | 10.1016/0031-9422(96)00164-1 |
| Molecular Weight | 458.549 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN3257 |