Spektraris NMR
Bolusanthol B
Common Name: Bolusanthol B
Synonyms: Bolusanthol B
CAS Registry Number:
InChI: InChI=1S/C20H20O6/c1-10(2)3-4-11-5-12(6-16(23)19(11)24)14-9-26-17-8-13(21)7-15(22)18(17)20(14)25/h3,5-8,14,21-24H,4,9H2,1-2H3
InChIKey: InChIKey=HCLPXVZSJXUHTK-UHFFFAOYSA-N
Formula: C20H20O6
Molecular Weight: 356.369963
Exact Mass: 356.125988
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Bojase G., Wanjala C.C., Majinda R.R. Phytochemistry (2001) 56, 837-41
Species:
Notes: Family : Flavonoids, Type : Isoflavonoids, Group : Isoflavanones; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 2 (CH2) | 71.7 |
| 3 (CH) | 50.6 |
| 4 (C) | 196.9 |
| 5 (C) | 165.2 |
| 6 (CH) | 95.4 |
| 7 (C) | 168.1 |
| 8 (CH) | 96.7 |
| 9 (C) | 163.6 |
| 10 (C) | 102.3 |
| 1' (C) | 127.2 |
| 2' (CH) | 113.3 |
| 3' (C) | 144.9 |
| 4' (C) | 142.9 |
| 5' (C) | 128.6 |
| 6' (CH) | 121.1 |
| 1'' (CH2) | 28.5 |
| 2'' (CH) | 123.1 |
| 3'' (C) | 131.9 |
| 4'' (CH3) | 17.3 |
| 5'' (CH3) | 25.4 |
