Spektraris NMR
C-3-epi-wilsonione
Common Name: C-3-epi-wilsonione
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H23NO5/c1-23-13-6-7-20-17(26-20)18(22)21-8-4-5-12-9-15(24-2)16(25-3)10-14(12)19(20,21)11-13/h6-7,9-10,13,17H,4-5,8,11H2,1-3H3/t13-,17-,19?,20-/m0/s1
InChIKey: InChIKey=POQQNJBRHJXAIN-KFLQCAKHSA-N
Formula: C20H23N1O5
Molecular Weight: 357.401123
Exact Mass: 357.157623
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wang, L.W., Su, H.J., Yang, S.Z., Won, S.J., Lin, C.N. J Nat Prod (2004) 67, 1182-5
Species:
Notes: Family : Alkaloids, Type : Homoerythrinas; 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 (CH) | 124.8 |
| 2 (CH) | 136.8 |
| 3 (CH) | 73.6 |
| 4 (CH2) | 38.7 |
| 5 (C) | 67.6 |
| 6 (C) | 65.9 |
| 7 (CH) | 59.7 |
| 8 (C) | 167.9 |
| 10 (CH2) | 41.2 |
| 11 (CH2) | 27.7 |
| 12 (CH2) | 36.3 |
| 13 (C) | 133.3 |
| 14 (C) | 128.3 |
| 15 (CH) | 112.3 |
| 16 (C) | 146.4 |
| 17 (C) | 148 |
| 18 (CH) | 115.3 |
| 3a (CH3) | 56.2 |
| 16a (CH3) | 56 |
| 17a (CH3) | 55.9 |
