Spektraris NMR
Tricalysiolide F
Common Name: Tricalysiolide F
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H26O5/c1-18-13(12-6-17(23)25-14(12)7-16(18)22)4-5-19-8-11(2-3-15(18)19)20(24,9-19)10-21/h6-7,11,13,15-16,21-22,24H,2-5,8-10H2,1H3/t11-,13-,15+,16-,18-,19+,20+/m1/s1
InChIKey: InChIKey=VUAWQNCRJHARRV-GQWJSDNQSA-N
Formula: C20H26O5
Molecular Weight: 346.418202
Exact Mass: 346.178024
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Nishimura, K., Hitotsuyanagi, Y., Sugeta, N., Sakakura, K., Fujita, K., Fukaya, H., Aoyagi, Y., Hasuda, T., Kinoshita, T., He, D.H., Otsuka, H., Takeda, Y., Takeya, K. Tetrahedron (2006) 62, 1512-9
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) | 69 |
| 2 (CH) | 109.3 |
| 3 (C) | 151.4 |
| 4 (C) | 160.3 |
| 5 (CH) | 39.2 |
| 6 (CH2) | 21.8 |
| 7 (CH2) | 40 |
| 8 (C) | 44.3 |
| 9 (CH) | 44.4 |
| 10 (C) | 44.3 |
| 11 (CH2) | 18.4 |
| 12 (CH2) | 26.4 |
| 13 (CH) | 46 |
| 14 (CH2) | 37.6 |
| 15 (CH2) | 53.9 |
| 16 (C) | 81.5 |
| 17 (CH2) | 66.4 |
| 18 (CH) | 111.7 |
| 19 (C) | 170.3 |
| 20 (CH3) | 16.1 |
