Spektraris NMR
Parvifoline K
Common Name: Parvifoline K
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H34O8/c1-19(2)6-5-13(24)21-14-12(23)7-10-8-20(14,16(25)11(10)9-28-3)22(27,17(26)15(19)21)30-18(21)29-4/h10-15,17-18,23-24,26-27H,5-9H2,1-4H3/t10-,11-,12+,13+,14-,15-,17+,18+,20+,21-,22+/m1/s1
InChIKey: InChIKey=YRVQGTNACPWQGA-GKGSLPFKSA-N
Formula: C22H34O8
Molecular Weight: 426.501415
Exact Mass: 426.225368
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) | 74.7 |
| 2 (CH2) | 29.3 |
| 3 (CH2) | 39.8 |
| 4 (C) | 34.2 |
| 5 (CH) | 61 |
| 6 (CH) | 74.4 |
| 7 (C) | 96.7 |
| 8 (C) | 60.6 |
| 9 (CH) | 59.8 |
| 10 (C) | 43.9 |
| 11 (CH) | 66.3 |
| 12 (CH2) | 30.6 |
| 13 (CH) | 29.6 |
| 14 (CH2) | 29.3 |
| 15 (C) | 225.3 |
| 16 (CH) | 59.3 |
| 17 (CH2) | 69.1 |
| 18 (CH3) | 33.2 |
| 19 (CH3) | 22.4 |
| 20 (CH) | 102.9 |
| 17a (CH3) | 58.7 |
| 20a (CH3) | 55.2 |
