Spektraris NMR
Disparinol D
Common Name: Disparinol D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H24O6/c1-12(2)17(25)10-16-22(28)20(21(27)13(3)4)23(29)19-15(11-18(26)30-24(16)19)14-8-6-5-7-9-14/h5-9,11,13,17,25,28-29H,1,10H2,2-4H3
InChIKey: InChIKey=HUJQDILIRUAUFY-UHFFFAOYSA-N
Formula: C24H24O6
Molecular Weight: 408.444669
Exact Mass: 408.157289
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Guilet D., Seraphin D., Rondeau D., Richomme P., Bruneton J. Phytochemistry (2001) 58, 571-5
Species:
Notes: Family : Flavonoids, Type : Neoflavonoids; 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 (C) | 159.9 |
| 3 (CH) | 112.2 |
| 4 (C) | 156.6 |
| 5 (C) | 163.4 |
| 6 (C) | 106.9 |
| 7 (C) | 162.1 |
| 8 (C) | 104.7 |
| 9 (C) | 157.7 |
| 10 (C) | 102.1 |
| 1' (C) | 139.4 |
| 2' (CH) | 127.1 |
| 3' (CH) | 127.7 |
| 4' (CH) | 128.2 |
| 5' (CH) | 127.7 |
| 6' (CH) | 127.1 |
| 6a (C) | 212.3 |
| 6b (CH) | 39.9 |
| 6c (CH3) | 19.2 |
| 6ba (CH3) | 19.2 |
| 8a (CH2) | 28.7 |
| 8b (CH) | 77.7 |
| 8c (C) | 146 |
| 8d (CH3) | 18.7 |
| 8ca (CH2) | 111.1 |
