Spektraris NMR
Yonarolide
Common Name: Yonarolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H20O4/c1-8(2)10-5-11(20)7-13-12(6-10)16-17-14(23-19(16)22)4-9(3)15(17)18(13)21/h10,14,16-17H,1,4-7H2,2-3H3/t10-,14-,16+,17-/m1/s1
InChIKey: InChIKey=BFJXMCOXWGLNFP-BFPUKSLXSA-N
Formula: C19H20O4
Molecular Weight: 312.360417
Exact Mass: 312.136159
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Sheu, J.H., Ahmed, A.F., Shiue, R.T., Dai, C.F., Kuo, Y.H. J Nat Prod (2002) 65, 1904-8
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 (CH) | 41.4 |
| 2 (CH2) | 47.1 |
| 3 (C) | 207.8 |
| 4 (CH2) | 39.5 |
| 5 (C) | 134.1 |
| 6 (C) | 183.3 |
| 7 (C) | 126.5 |
| 8 (C) | 150.7 |
| 9 (CH2) | 45.7 |
| 10 (CH) | 80.9 |
| 11 (CH) | 50.1 |
| 12 (CH) | 47.5 |
| 13 (C) | 149.1 |
| 14 (CH2) | 38.5 |
| 15 (C) | 149.9 |
| 16 (CH2) | 111 |
| 17 (CH3) | 21.4 |
| 18 (CH3) | 15.7 |
| 19 (C) | 172.4 |
