Spektraris NMR
Luffariellolide
Common Name: Luffariellolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H38O3/c1-18(11-7-13-21-17-23(26)28-24(21)27)9-6-10-19(2)14-15-22-20(3)12-8-16-25(22,4)5/h10-11,17,24,27H,6-9,12-16H2,1-5H3/b18-11+,19-10+
InChIKey: InChIKey=JPWPYTMXSXYUPG-QZPYEDBESA-N
Formula: C25H38O3
Molecular Weight: 386.568361
Exact Mass: 386.282095
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) | 173.5 |
| 2 (CH) | 117.8 |
| 3 (C) | 171.7 |
| 4 (CH2) | 28.7 |
| 5 (CH2) | 26.2 |
| 6 (CH) | 124 |
| 7 (C) | 137.8 |
| 8 (CH2) | 40.6 |
| 9 (CH2) | 27.4 |
| 10 (CH) | 124.6 |
| 11 (C) | 137.1 |
| 12 (CH2) | 41.5 |
| 13 (CH2) | 29.5 |
| 14 (C) | 138.2 |
| 15 (C) | 128.1 |
| 16 (CH2) | 33.7 |
| 17 (CH2) | 20.6 |
| 18 (CH2) | 41 |
| 19 (C) | 35.9 |
| 20 (CH3) | 29.1 |
| 21 (CH3) | 20.5 |
| 22 (CH3) | 29.1 |
| 23 (CH3) | 16.1 |
| 24 (CH3) | 16.2 |
| 25 (CH) | 101 |
