Spektraris NMR
Grandilobatin C
Common Name: Grandilobatin C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O3/c1-14-7-6-8-19(22)16(3)13-17(20(4,5)23)10-9-15(2)12-18(21)11-14/h7,13,15-16,23H,6,8-12H2,1-5H3/b14-7+,17-13+/t15-,16+/m0/s1
InChIKey: InChIKey=KNDKWZIZEPJABD-FRIJAAEYSA-N
Formula: C20H32O3
Molecular Weight: 320.467037
Exact Mass: 320.235145
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ahmed, A.F., Tai, S.H., Wen, Z.H., Su, J.H., Wu, Y.C., Hu, W.P., Sheu, J.H. J Nat Prod (2008) 71, 946-51
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Cembranes; 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 (C) | 147.9 |
| 2 (CH) | 122.6 |
| 3 (CH) | 47.8 |
| 4 (C) | 213.2 |
| 5 (CH2) | 39.5 |
| 6 (CH2) | 24.4 |
| 7 (CH) | 127.6 |
| 8 (C) | 130.5 |
| 9 (CH2) | 52.9 |
| 10 (C) | 208.2 |
| 11 (CH2) | 49.6 |
| 12 (CH) | 29 |
| 13 (CH2) | 35.8 |
| 14 (CH2) | 24.1 |
| 15 (C) | 73.7 |
| 16 (CH3) | 29.2 |
| 17 (CH3) | 29.4 |
| 18 (CH3) | 16.8 |
| 19 (CH3) | 17.8 |
| 20 (CH3) | 19.4 |
