Spektraris NMR
25-O-Ethoxyluffariellolide
Common Name: 25-O-Ethoxyluffariellolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C27H42O3/c1-7-29-26-23(19-25(28)30-26)15-9-13-20(2)11-8-12-21(3)16-17-24-22(4)14-10-18-27(24,5)6/h12-13,19,26H,7-11,14-18H2,1-6H3/b20-13+,21-12+
InChIKey: InChIKey=CFCUAIAPOSWTBK-KVDUHBSMSA-N
Formula: C27H42O3
Molecular Weight: 414.621596
Exact Mass: 414.313395
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Elkhayat, E., Edrada, R., Ebel, R., Wray, V., van Soest, R., Wiryowidagdo, S., Mohamed, M.H., Muller, W.E., Proksch, P. J Nat Prod (2004) 67, 1809-17
Species:
Notes: Family : Terpenoids, Type : Sesterterpenoids, Group : Monocarbocyclics; 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 (C) | 172.6 |
| 2 (CH) | 118.5 |
| 3 (C) | 170.3 |
| 4 (CH2) | 28.7 |
| 5 (CH2) | 26.2 |
| 6 (CH) | 124 |
| 7 (C) | 137.9 |
| 8 (CH2) | 40.7 |
| 9 (CH2) | 27.4 |
| 10 (CH) | 124.7 |
| 11 (C) | 137.2 |
| 12 (CH2) | 41.5 |
| 13 (CH2) | 29.2 |
| 14 (C) | 138.3 |
| 15 (C) | 128.1 |
| 16 (CH2) | 33.7 |
| 17 (CH2) | 20.6 |
| 18 (CH2) | 41 |
| 19 (C) | 35.9 |
| 20 (CH3) | 29.2 |
| 21 (CH3) | 20.6 |
| 22 (CH3) | 29.2 |
| 23 (CH3) | 16.1 |
| 24 (CH3) | 16.2 |
| 25 (CH) | 105.6 |
| 25a (CH2) | 67.1 |
| 25b (CH3) | 15.5 |
