Spektraris NMR
3β-Senecioyloxy-6β-hydroxyeremophil-1(10)-ene
Common Name: 3β-Senecioyloxy-6β-hydroxyeremophil-1(10)-ene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H26O4/c1-11(2)8-17(21)24-15-7-6-14-9-16-18(12(3)10-23-16)19(22)20(14,5)13(15)4/h6,8,10,13,15,19,22H,7,9H2,1-5H3/t13-,15-,19+,20+/m0/s1
InChIKey: InChIKey=JMPCBBCNNVGUKM-DZXDFRQDSA-N
Formula: C20H26O4
Molecular Weight: 330.418797
Exact Mass: 330.183109
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Burgueno-Tapia, E., Lopez-Escobedo, S., Gonzalez-Ledesma, M., Joseph-Nathan, P. Magn Reson Chem (2007) 45, 457-62
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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) | 119.5 |
| 2 (CH2) | 27 |
| 3 (CH) | 69.6 |
| 4 (CH) | 35.2 |
| 5 (C) | 45.8 |
| 6 (CH) | 71.7 |
| 7 (C) | 119.6 |
| 8 (C) | 149.6 |
| 9 (CH2) | 31 |
| 10 (C) | 136.9 |
| 11 (C) | 120.4 |
| 12 (CH) | 138.2 |
| 13 (CH3) | 9.4 |
| 14 (CH3) | 16 |
| 15 (CH3) | 9.4 |
| 3a (C) | 166 |
| 3b (CH) | 116.2 |
| 3c (C) | 156.3 |
| 3d (CH3) | 20.4 |
| 3ca (CH3) | 27.5 |
