Spektraris NMR
Garciniaflavone C
Common Name: Garciniaflavone C
Synonyms: 4H-1-Benzopyran-4-one, 8-[6-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2,2-dimethyl-2H-1-benzopyran-8-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-
CAS Registry Number: 1622306-46-0
InChI:
InChIKey:
Formula: C35H24O10
Molecular Weight: 604.567
Exact Mass: 604.13695
NMR Solvent: acetone-d6
MHz: 400 (1H), 100 (13C)
Calibration: TMS
NMR references: Ito, T., Yokota, R., Watarai, T., Mori, K., Oyama, M., Nagasawa, H., Matsuda, H., Iinuma, M. (2013). Isolation of Six Isoprenylated Biflavonoids from the Leaves of Garcinia subelliptica. Chem Pharm. Bull. 61, 551-558.
Species: Garcinia subelliptica - Ito, T., Yokota, R., Watarai, T., Mori, K., Oyama, M., Nagasawa, H., Matsuda, H., Iinuma, M. (2013). Isolation of Six Isoprenylated Biflavonoids from the Leaves of Garcinia subelliptica. Chem Pharm. Bull. 61, 551-558.
Notes:
Proton NMR Peaks
| Position | PPM | Peak Type | J (Hz) |
|---|---|---|---|
| 3 | 6.89 | s | |
| 6 | 6.21 | d | 2.4 |
| 8 | 6.49 | d | 2 |
| 2' | 7.97 | d | 2.4 |
| 6' | 7.93 | d | 2.4 |
| 3" | 6.82 | s | |
| 6" | 6.42 | s | |
| 2''' | 7.58 | d | 8.8 |
| 3''' | 6.7 | d | 8.8 |
| 5''' | 6.7 | d | 8.8 |
| 6''' | 7.58 | d | 8.8 |
| 1'''' | 6.62 | d | 10 |
| 2'''' | 5.86 | d | 10 |
| 4'''' | 1.15 | s | |
| 5'''' | 1.31 | s | |
| 5-OH | 12.94 | s | |
| 5"-OH | 13.12 | s |
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 2 | 163.4 |
| 3 (signal overlaps with 10") | 103.5 |
| 4 | 181.7 |
| 5 | 161.4 |
| 6 | 98.9 |
| 7 | 163.7 |
| 8 | 94.1 |
| 9 | 157.4 |
| 10 | 103.7 |
| 1' | 122.3 |
| 2' | 130.8 |
| 3' | 120.6 |
| 4' | 154.2 |
| 5' | 121.3 |
| 6' | 124.3 |
| 2" | 163.6 |
| 3" | 102.5 |
| 4" | 182.1 |
| 5" | 161 |
| 6" | 98.5 |
| 7" | 161.8 |
| 8" | 103.1 |
| 9" | 154.2 |
| 10" (signal overlaps with 3) | 103.5 |
| 1''' | 121.3 |
| 2''' | 128.2 |
| 3''' | 115.7 |
| 4''' | 160.6 |
| 5''' | 115.7 |
| 6''' | 128.2 |
| 1'''' | 121.3 |
| 2'''' | 31.7 |
| 3'''' | 77.7 |
| 4'''' | 28.2 |
| 5'''' | 28 |
