Spektraris NMR
Chiricanine E
Common Name: Chiricanine E
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H28O3/c1-16(2)10-12-19-18(13-11-17-8-6-5-7-9-17)20-14-23(24(3,4)26)27-22(20)15-21(19)25/h5-11,13,15,23,25-26H,12,14H2,1-4H3/b13-11-
InChIKey: InChIKey=FSSUIGNVZSBFPI-QBFSEMIESA-N
Formula: C24H28O3
Molecular Weight: 364.478217
Exact Mass: 364.203845
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ioset, J.R., Marston, A., Gupta, M.P., Hostettmann, K. J Nat Prod (2001) 64, 710-5
Species:
Notes: Family : Aromatics, Type : Stilbenes; 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) | 137.1 |
| 2 (CH) | 128.3 |
| 3 (CH) | 128.4 |
| 4 (CH) | 127.4 |
| 5 (CH) | 128.4 |
| 6 (CH) | 128.3 |
| α (CH) | 131.7 |
| β (CH) | 127.4 |
| 1' (C) | 134.2 |
| 2' (C) | 117.2 |
| 3' (C) | 158.6 |
| 4' (CH) | 96.9 |
| 5' (C) | 154.6 |
| 6' (C) | 116.2 |
| 1'' (CH2) | 30.2 |
| 2'' (CH) | 89.6 |
| 3'' (C) | 72 |
| 4'' (CH3) | 23.4 |
| 5'' (CH3) | 25.4 |
| 1''' (CH2) | 26.5 |
| 2''' (CH) | 122.2 |
| 3''' (C) | 134.6 |
| 4''' (CH3) | 17.8 |
| 5''' (CH3) | 25.7 |
