Spektraris NMR
ent-Yahazunol
Common Name: ent-Yahazunol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H32O3/c1-19(2)9-5-10-20(3)17(19)8-11-21(4,24)18(20)13-14-12-15(22)6-7-16(14)23/h6-7,12,17-18,22-24H,5,8-11,13H2,1-4H3/t17-,18+,20-,21+/m0/s1
InChIKey: InChIKey=ZXQLWSVBDXTOCU-IZZBFERCSA-N
Formula: C21H32O3
Molecular Weight: 332.477773
Exact Mass: 332.235145
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Perez-Garcia, E., Zubia, E., Ortega, M.J., Carballo, J.L. J Nat Prod (2005) 68, 653-8
Species:
Notes: Family : Terpenoids, Type : Merosesquiterpenoids, Group : Drimanes; 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 (CH2) | 40.3 |
| 2 (CH2) | 18.2 |
| 3 (CH2) | 41.5 |
| 4 (C) | 33.1 |
| 5 (CH) | 55.7 |
| 6 (CH2) | 20.4 |
| 7 (CH2) | 43.9 |
| 8 (C) | 76.1 |
| 9 (CH) | 60.6 |
| 10 (C) | 39.8 |
| 11 (CH2) | 27.4 |
| 12 (CH3) | 24.7 |
| 13 (CH3) | 33.3 |
| 14 (CH3) | 21.4 |
| 15 (CH3) | 15.4 |
| 1' (C) | 130.2 |
| 2' (C) | 147.9 |
| 3' (CH) | 117.2 |
| 4' (CH) | 114 |
| 5' (C) | 149.3 |
| 6' (CH) | 118.2 |
