Spektraris NMR
Sinularolide A
Common Name: Sinularolide A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O6/c1-12-6-4-8-13(2)17(23)18-15(14(3)19(24)26-18)10-16(22)20(25,11-21)9-5-7-12/h7-8,15-18,21-23,25H,3-6,9-11H2,1-2H3/b12-7+,13-8+/t15-,16+,17+,18-,20+/m1/s1
InChIKey: InChIKey=OZILXJUBBKPMRE-HAUURUDMSA-N
Formula: C20H30O6
Molecular Weight: 366.44937
Exact Mass: 366.204239
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Li, G., Zhang, Y., Deng, Z., van Ofwegen, L., Proksch, P., Lin, W. J Nat Prod (2005) 68, 649-52
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Cembranes; 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) | 38.1 |
| 2 (CH) | 83.2 |
| 3 (CH) | 79.7 |
| 4 (C) | 132 |
| 5 (CH) | 131.2 |
| 6 (CH2) | 23.6 |
| 7 (CH2) | 37.5 |
| 8 (C) | 137.3 |
| 9 (CH) | 124.3 |
| 10 (CH2) | 21.6 |
| 11 (CH2) | 32.5 |
| 12 (C) | 75.4 |
| 13 (CH) | 71.9 |
| 14 (CH2) | 34.9 |
| 15 (C) | 138.2 |
| 16 (C) | 169.4 |
| 17 (CH2) | 123.5 |
| 18 (CH3) | 13.1 |
| 19 (CH3) | 17.3 |
| 20 (CH2) | 67.5 |
