Spektraris NMR
Sinulaflexiolide B
Common Name: Sinulaflexiolide B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O6/c1-12-13-5-9-19(3,26-17(12)23)14(21)6-8-18(2,24)16-7-10-20(4,25-16)15(22)11-13/h13-16,21-22,24H,1,5-11H2,2-4H3/t13-,14-,15+,16+,18+,19-,20-/m1/s1
InChIKey: InChIKey=JROSFLRPNMYWEE-BHNPYSKESA-N
Formula: C20H32O6
Molecular Weight: 368.465252
Exact Mass: 368.219889
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wen, T., Ding, Y., Deng, Z., van Ofwegen, L., Proksch, P., Lin, W. J Nat Prod (2008) 71, 1133-40
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) | 33.2 |
| 2 (CH2) | 29.7 |
| 3 (CH2) | 33.7 |
| 4 (C) | 91.3 |
| 5 (CH) | 71.9 |
| 6 (CH2) | 27 |
| 7 (CH2) | 40 |
| 8 (C) | 73.4 |
| 9 (CH) | 85.3 |
| 10 (CH2) | 25.4 |
| 11 (CH2) | 37.5 |
| 12 (C) | 87.5 |
| 13 (CH) | 73.8 |
| 14 (CH2) | 37.7 |
| 15 (C) | 145.9 |
| 16 (C) | 169.2 |
| 17 (CH2) | 123.2 |
| 18 (CH3) | 24 |
| 19 (CH3) | 19.6 |
| 20 (CH3) | 16.1 |
