Spektraris NMR
Nervonin G
Common Name: Nervonin G
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C26H38O9/c1-11-15-8-16(30)20-25(7)18(33-12(2)27)9-17(31)24(5,6)21(25)19(34-13(3)28)23(35-14(4)29)26(20,10-15)22(11)32/h15-23,30-32H,1,8-10H2,2-7H3/t15-,16+,17+,18+,19-,20+,21-,22-,23+,25+,26+/m1/s1
InChIKey: InChIKey=DRJJWTMAGJAYQX-LBFLOJCHSA-N
Formula: C26H38O9
Molecular Weight: 494.575526
Exact Mass: 494.251583
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) | 81 |
| 2 (CH2) | 32.2 |
| 3 (CH) | 76 |
| 4 (C) | 37.7 |
| 5 (CH) | 40.3 |
| 6 (CH) | 70.4 |
| 7 (CH) | 76.3 |
| 8 (C) | 45.7 |
| 9 (CH) | 51.4 |
| 10 (C) | 42.4 |
| 11 (CH) | 66.3 |
| 12 (CH2) | 42.1 |
| 13 (CH) | 38.7 |
| 14 (CH2) | 35.5 |
| 15 (CH) | 80.7 |
| 16 (C) | 155.7 |
| 17 (CH2) | 106.9 |
| 18 (CH3) | 28.5 |
| 19 (CH3) | 23.6 |
| 20 (CH3) | 14.6 |
| 1a (C) | 171.1 |
| 1b (CH3) | 21.7 |
| 6a (C) | 170.1 |
| 6b (CH3) | 21.4 |
| 7a (C) | 169.2 |
| 7b (CH3) | 21.3 |
