Spektraris NMR
Salvimadrensin
Common Name: Salvimadrensin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H26O5/c1-12-4-3-5-15-19(2,8-6-13-7-9-24-17(13)22)14-10-16(21)20(12,15)11-25-18(14)23/h4,7,14-16,21H,3,5-6,8-11H2,1-2H3/t14-,15+,16-,19-,20-/m0/s1
InChIKey: InChIKey=UGJRFUBZMMXTKY-MHZKCTCGSA-N
Formula: C20H26O5
Molecular Weight: 346.418202
Exact Mass: 346.178024
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rodriguezhahn, L., Alvarado, G., Cardenas, J., Esquivel, B., Gavino, R. Phytochemistry (1994) 35, 447-50
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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 (CH2) | 20.3 |
| 2 (CH2) | 25.6 |
| 3 (CH) | 127.6 |
| 4 (C) | 134.3 |
| 5 (C) | 46.2 |
| 6 (CH) | 71.4 |
| 7 (CH2) | 33 |
| 8 (CH) | 48.4 |
| 9 (C) | 35.8 |
| 10 (CH) | 44.4 |
| 11 (CH2) | 37.9 |
| 12 (CH2) | 19.2 |
| 13 (C) | 134 |
| 14 (CH) | 144.5 |
| 15 (CH2) | 70.1 |
| 16 (C) | 174 |
| 17 (C) | 175.1 |
| 18 (CH3) | 20.7 |
| 19 (CH2) | 66.8 |
| 20 (CH3) | 19.8 |
