| SpectraBase Compound ID | 6icOA3lYfqI |
|---|---|
| InChI | InChI=1S/C39H36O9/c1-19(2)4-8-26-30(42)11-10-27(38(26)46)39(47)36-28(25-9-7-23(40)17-31(25)43)12-20(3)13-29(36)37-32(44)14-22(15-33(37)45)34-16-21-5-6-24(41)18-35(21)48-34/h4-7,9-11,13-18,28-29,36,40-46H,8,12H2,1-3H3 |
| InChIKey | SEHVRKPXIDOTRX-UHFFFAOYSA-N |
| Mol Weight | 648.7 g/mol |
| Molecular Formula | C39H36O9 |
| Exact Mass | 648.235933 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KtMMSQmxGJI |
|---|---|
| Name | CHALCOMORACIN |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H36O9 |
| InChI | InChI=1S/C39H36O9/c1-19(2)4-8-26-30(42)11-10-27(38(26)46)39(47)36-28(25-9-7-23(40)17-31(25)43)12-20(3)13-29(36)37-32(44)14-22(15-33(37)45)34-16-21-5-6-24(41)18-35(21)48-34/h4-7,9-11,13-18,28-29,36,40-46H,8,12H2,1-3H3 |
| InChIKey | SEHVRKPXIDOTRX-UHFFFAOYSA-N |
| Literature Reference Author | J.KANG,R.Y.CHEN,D.Q.YU |
| Literature Reference Citation | PLANTA.MED.,72,52(2006) |
| Literature Reference DOI | 10.1055/s-2005-873190 |
| Molecular Weight | 648.709 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWMZ47248 |