Spektraris NMR
Nervonin H
Common Name: Nervonin H
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H36O7/c1-11-14-7-15(30-12(2)25)20-23(6)16(22(4,5)17(27)9-18(23)28)8-19(31-13(3)26)24(20,10-14)21(11)29/h14-21,27-29H,1,7-10H2,2-6H3/t14-,15+,16-,17+,18+,19+,20+,21-,23+,24+/m1/s1
InChIKey: InChIKey=IGTOQFPPVHITJK-KNGCFTRFSA-N
Formula: C24H36O7
Molecular Weight: 436.539363
Exact Mass: 436.246104
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Li, L.M., Li, G.Y., Ding, L.S., Yang, L.B., Zhao, Y., Pu, H.X., Xiao, W.L., Han, Q.B., Sun, H.D. J Nat Prod (2008) 71, 684-8
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) | 76.1 |
| 2 (CH2) | 38.1 |
| 3 (CH) | 75.8 |
| 4 (C) | 37.7 |
| 5 (CH) | 39.3 |
| 6 (CH2) | 25.1 |
| 7 (CH) | 79.3 |
| 8 (C) | 48.1 |
| 9 (CH) | 50.9 |
| 10 (C) | 43.9 |
| 11 (CH) | 72.1 |
| 12 (CH2) | 39.7 |
| 13 (CH) | 38.8 |
| 14 (CH2) | 35.5 |
| 15 (CH) | 81.5 |
| 16 (C) | 158.8 |
| 17 (CH2) | 105.4 |
| 18 (CH3) | 29 |
| 19 (CH3) | 22.4 |
| 20 (CH3) | 13.9 |
| 7a (C) | 170.8 |
| 7b (CH3) | 21.7 |
| 11a (C) | 169.1 |
| 11b (CH3) | 21.6 |
