Spektraris NMR
Matairesinol
Common Name: Matairesinol
Synonyms: Matairesinol
CAS Registry Number:
InChI: InChI=1S/C20H22O6/c1-24-18-9-12(3-5-16(18)21)7-14-11-26-20(23)15(14)8-13-4-6-17(22)19(10-13)25-2/h3-6,9-10,14-15,21-22H,7-8,11H2,1-2H3/t14-,15+/m0/s1
InChIKey: InChIKey=MATGKVZWFZHCLI-LSDHHAIUSA-N
Formula: C20H22O6
Molecular Weight: 358.385844
Exact Mass: 358.141638
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Umehara, K., Sugawa, A., Kuroyanagi, M., Ueno, A., Taki, T. Chem Pharm Bull (1993) 41, 1774-9
Species:
Notes: Family : Lignans, Type : Lignans, Group : Dibenzylbutyrolactones; 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 |
|---|---|
| 1 (C) | 129.7 |
| 2 (CH) | 111.5 |
| 3 (C) | 146.6 |
| 4 (C) | 144.4 |
| 5 (CH) | 114.3 |
| 6 (CH) | 122 |
| 7 (CH2) | 34.5 |
| 8 (CH) | 46.4 |
| 9 (C) | 178.6 |
| 1' (C) | 129.4 |
| 2' (CH) | 111 |
| 3' (C) | 146.5 |
| 4' (C) | 144.3 |
| 5' (CH) | 114 |
| 6' (CH) | 121.2 |
| 7' (CH2) | 38.2 |
| 8' (CH) | 40.9 |
| 9' (CH2) | 71.2 |
| 3a (CH3) | 55.7 |
| 3'a (CH3) | 55.7 |
