Spektraris NMR
Siderol
Common Name: Siderol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H34O3/c1-14-11-22-12-16(14)6-7-17(22)21(4)9-5-8-20(3,13-23)18(21)10-19(22)25-15(2)24/h11,16-19,23H,5-10,12-13H2,1-4H3/t16-,17+,18-,19+,20-,21+,22+/m1/s1
InChIKey: InChIKey=OFNWUWHDGCNABD-CSGHFTSRSA-N
Formula: C22H34O3
Molecular Weight: 346.50439
Exact Mass: 346.250795
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Baser, K.H.C., Bondi, M.L., Bruno, M., Kirimer, N., Piozzi, F., Tumen, G., Vassallo, N. Phytochemistry (1996) 43, 1293-5
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 42 |
| 2 (CH2) | 18.3 |
| 3 (CH2) | 35.2 |
| 4 (C) | 37 |
| 5 (CH) | 44.5 |
| 6 (CH2) | 23.5 |
| 7 (CH) | 78.2 |
| 8 (C) | 51.8 |
| 9 (CH) | 44.8 |
| 10 (C) | 39.1 |
| 11 (CH2) | 17.9 |
| 12 (CH2) | 24.7 |
| 13 (CH) | 39.8 |
| 14 (CH2) | 39.8 |
| 15 (CH) | 129.8 |
| 16 (C) | 143.8 |
| 17 (CH3) | 15.3 |
| 18 (CH2) | 71.4 |
| 19 (CH3) | 17.3 |
| 20 (CH3) | 17.7 |
| 7a (C) | 170.8 |
| 7b (CH3) | 21.4 |
