Spektraris NMR
Hookerianolides C
Common Name: Hookerianolides C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H32O6/c1-6-26-22-10-13(19(25)28-22)7-8-14-15(20(14,3)4)9-12(2)16(23)17(24)18-21(5,11-22)27-18/h9-10,14-18,23-24H,6-8,11H2,1-5H3/b12-9+/t14-,15+,16-,17-,18+,21+,22+/m1/s1
InChIKey: InChIKey=KLBLYASTLCKTIJ-SXRJHKEMSA-N
Formula: C22H32O6
Molecular Weight: 392.486723
Exact Mass: 392.219889
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Bai, Y., Yang, Y.P., Ye, Y. Tetrahedron Lett (2006) 47, 6637-40
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Casbanes; 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) | 30.5 |
| 2 (CH) | 26.9 |
| 3 (CH) | 128.7 |
| 4 (C) | 135.5 |
| 5 (CH) | 81.9 |
| 6 (CH) | 71 |
| 7 (CH) | 63.3 |
| 8 (C) | 60 |
| 9 (CH2) | 48.6 |
| 10 (C) | 107.7 |
| 11 (CH) | 145.7 |
| 12 (C) | 137.8 |
| 13 (CH2) | 26.8 |
| 14 (CH2) | 21.8 |
| 15 (C) | 21.8 |
| 16 (CH3) | 15.5 |
| 17 (CH3) | 28.6 |
| 18 (CH3) | 11.4 |
| 19 (CH3) | 19.7 |
| 20 (C) | 170.7 |
| 10a (CH2) | 59.6 |
| 10b (CH3) | 15.2 |
