Spektraris NMR
Kuhistanicaol F
Common Name: Kuhistanicaol F
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C23H32O5/c1-14(2)23(26)11-10-22(4)13-18(24)15(3)12-19(20(22)23)28-21(25)16-6-8-17(27-5)9-7-16/h6-9,12,14,18-20,24,26H,10-11,13H2,1-5H3/t18-,19+,20-,22-,23-/m1/s1
InChIKey: InChIKey=RPZVBOQULYFWQB-QGAVKGNSSA-N
Formula: C23H32O5
Molecular Weight: 388.498054
Exact Mass: 388.224974
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Chen, B., Teranishi, R., Kawazoe, K., Takaishi, Y., Honda, G., Itoh, M., Takeda, Y., Kodzhimatov, O.K. Phytochemistry (2000) 54, 717-22
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Daucanes; 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) | 42.2 |
| 2 (CH2) | 42 |
| 3 (CH2) | 31.8 |
| 4 (C) | 86.5 |
| 5 (CH) | 54 |
| 6 (CH) | 72.7 |
| 7 (CH) | 128 |
| 8 (C) | 136.9 |
| 9 (CH) | 83.2 |
| 10 (CH2) | 44.5 |
| 11 (CH) | 37 |
| 12 (CH3) | 17.4 |
| 13 (CH3) | 18.4 |
| 14 (CH3) | 24.2 |
| 15 (CH3) | 19.9 |
| 1' (C) | 122.5 |
| 2' (CH) | 131.9 |
| 3' (CH) | 113.8 |
| 4' (C) | 163.7 |
| 5' (CH) | 113.8 |
| 6' (CH) | 131.9 |
| 7' (C) | 166.7 |
| 4'a (CH3) | 55.5 |
