Common Name: Agathisflavone
Synonyms: 8-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-6-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
CAS Registry Number: 28441-98-7
InChI:
InChIKey:
Formula: C30H18O10
Molecular Weight: 538.464
Exact Mass: 538.09
NMR Solvent: DMSO-d6
MHz: 25.16
Calibration: TMS
NMR references: Chari, V., Ilyas, M., Hildebert, W., Neszmelyi, A., Chen, F., Chen, L., Lin, Y., Lin, Y. (1977). 13C-NMR Spectroscopy of Biflavanoids. Phytochemistry 16, 1273-1278.
Species: Rhus succedanea
Notes:
Position | PPM |
---|---|
2 (may be reversed with 2'') | 164.1 |
3 (may be reversed with 3'') | 103.1 |
4 (may be reversed with 4'') | 182.3 |
5 | 160 |
6 (may be reversed with I-10, 10'') | 103.6 |
7 (may be reversed with 7'') | 162.9 |
8 | 93.7 |
9 (may be reversed with 9'') | 157 |
10 (may be reversed with I-6, 10'') | 103.8 |
1' (may be reversed with 1''') | 121.5 |
2' (may be reversed with 6', 2''', 6''') | 128.6 |
3' | 116.2 |
4' | 161.3 |
5' | 116.2 |
6' (may be reversed with 2', 2''', 6''') | 128.6 |
2'' (may be reversed with 2) | 163.9 |
3'' (may be reversed with 3) | 102.8 |
4'' (may be reversed with 4) | 182.1 |
5'' | 160.9 |
6'' | 98.9 |
7'' (may be reversed with 7) | 162.7 |
8'' | 99.4 |
9'' (may be reversed with 9) | 155.1 |
10'' (may be reversed with 6, 10) | 104 |
1''' (may be reversed with 1') | 121.7 |
2''' (may be reversed with 2', 6', 6''') | 128.2 |
3''' | 116.2 |
4''' | 161.2 |
5''' | 116.2 |
6''' (may be reversed with 2', 6', 2''') | 128.2 |