Spektraris NMR
Bolusanthol A
Common Name: Bolusanthol A
Synonyms: Bolusanthol A
CAS Registry Number:
InChI: InChI=1S/C16H14O7/c17-10-2-1-7(15(19)16(10)20)9-5-21-11-4-13-12(22-6-23-13)3-8(11)14(9)18/h1-4,9,14,17-20H,5-6H2/t9-,14+/m0/s1
InChIKey: InChIKey=FABXQJSQWANGCE-LKFCYVNXSA-N
Formula: C16H14O7
Molecular Weight: 318.278779
Exact Mass: 318.073953
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) | 67.4 |
| 3 (CH) | 40.7 |
| 4 (CH) | 78.7 |
| 5 (CH) | 105 |
| 6 (C) | 142.2 |
| 7 (C) | 148.6 |
| 8 (CH) | 94.3 |
| 9 (C) | 154.7 |
| 10 (C) | 117.9 |
| 1' (C) | 112.1 |
| 2' (C) | 143.5 |
| 3' (C) | 131.9 |
| 4' (C) | 144.8 |
| 5' (CH) | 110 |
| 6' (CH) | 122.1 |
| 6a (CH2) | 101.7 |
