Spektraris NMR
Viteagnusin D
Common Name: Viteagnusin D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H36O2/c1-7-18(5,21)13-14-20(22)15(2)9-10-16-17(3,4)11-8-12-19(16,20)6/h7,15-16,21-22H,1,8-14H2,2-6H3/t15-,16+,18?,19+,20-/m1/s1
InChIKey: InChIKey=QNIUYBRZAVVKNV-NJNUCJBSSA-N
Formula: C20H36O2
Molecular Weight: 308.499395
Exact Mass: 308.27153
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ono, M., Yamasaki, T., Konoshita, M., Ikeda, T., Okawa, M., Kinjo, J., Yoshimitsu, H., Nohara, T. Chem Pharm Bull (2008) 56, 1621-4
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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 (CH2) | 32.4 |
| 2 (CH2) | 18.8 |
| 3 (CH2) | 41.8 |
| 4 (C) | 33.4 |
| 5 (CH) | 46.4 |
| 6 (CH2) | 21.7 |
| 7 (CH2) | 31.5 |
| 8 (CH) | 36.8 |
| 9 (C) | 76.8 |
| 10 (C) | 43.6 |
| 11 (CH2) | 28 |
| 12 (CH2) | 37.5 |
| 13 (C) | 73.5 |
| 14 (CH) | 145.4 |
| 15 (CH2) | 111.7 |
| 16 (CH3) | 27.9 |
| 17 (CH3) | 16.6 |
| 18 (CH3) | 33.8 |
| 19 (CH3) | 22 |
| 20 (CH3) | 16.3 |
