Spektraris NMR
(7E,13Z,18R,20Z)-Felixinin acetate
Common Name: (7E,13Z,18R,20Z)-Felixinin acetate
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C27H36O5/c1-19(9-6-10-20(2)12-8-14-24-15-16-30-18-24)11-7-13-21(3)17-25-26(31-23(5)28)22(4)27(29)32-25/h11-12,15-18,21H,6-10,13-14H2,1-5H3/b19-11-,20-12+,25-17-/t21-/m1/s1
InChIKey: InChIKey=YJYOZXJUALIHQD-CZENFQQESA-N
Formula: C27H36O5
Molecular Weight: 440.572761
Exact Mass: 440.256274
NMR Solvent: C+C
MHz:
Calibration:
NMR references: 13C - Martinez, A., Duque, C., Sato, N., Fujimoto, Y. Chem Pharm Bull (1997) 45, 181-4
Species:
Notes: Family : Terpenoids, Type : Sesterterpenoids, Group : Acyclics; 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) | 142.47 |
| 2 (CH) | 111.03 |
| 3 (C) | 124.93 |
| 4 (CH) | 138.72 |
| 5 (CH2) | 24.99 |
| 6 (CH2) | 28.37 |
| 7 (CH) | 123.65 |
| 8 (C) | 135.78 |
| 9 (CH3) | 15.9 |
| 10 (CH2) | 39.49 |
| 11 (CH2) | 26.25 |
| 12 (CH2) | 31.34 |
| 13 (C) | 135.83 |
| 14 (CH3) | 23.36 |
| 15 (CH) | 124.37 |
| 16 (CH2) | 25.68 |
| 17 (CH2) | 37.39 |
| 18 (CH) | 30.88 |
| 19 (CH3) | 20.49 |
| 20 (CH) | 116.48 |
| 21 (C) | 142.36 |
| 22 (C) | 154.27 |
| 23 (C) | 114.66 |
| 24 (C) | 168.62 |
| 25 (CH3) | 8.35 |
| 22a (C) | 165.35 |
| 22b (CH3) | 20.42 |
