Spektraris NMR
Parvifoline J
Common Name: Parvifoline J
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C23H34O8/c1-11(24)31-14-7-12-8-22(18(26)13(12)9-29-4)16(14)21-10-30-23(22,28)19(27)17(21)20(2,3)6-5-15(21)25/h12-17,19,25,27-28H,5-10H2,1-4H3/t12-,13-,14+,15+,16+,17-,19+,21+,22+,23+/m1/s1
InChIKey: InChIKey=HSPWQVFLXJMEHX-YYACTILMSA-N
Formula: C23H34O8
Molecular Weight: 438.512151
Exact Mass: 438.225368
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Li, L.M., Li, G.Y., Huang, S.X., Li, S.H., Zhou, Y., Xiao, W.L., Lou, L.G., Ding, L.S., Sun, H.D. J Nat Prod (2006) 69, 645-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 72.1 |
| 2 (CH2) | 29.7 |
| 3 (CH2) | 39.3 |
| 4 (C) | 34.2 |
| 5 (CH) | 61.8 |
| 6 (CH) | 74.3 |
| 7 (C) | 95.6 |
| 8 (C) | 60.9 |
| 9 (CH) | 54.9 |
| 10 (C) | 42 |
| 11 (CH) | 67.9 |
| 12 (CH2) | 27.4 |
| 13 (CH) | 29.6 |
| 14 (CH2) | 30 |
| 15 (C) | 224.3 |
| 16 (CH) | 58.4 |
| 17 (CH2) | 68.9 |
| 18 (CH3) | 32.8 |
| 19 (CH3) | 21.9 |
| 20 (CH2) | 64.9 |
| 11a (C) | 170.3 |
| 11b (CH3) | 21.6 |
| 17a (CH3) | 58.7 |
