Spektraris NMR
ent-19-hydroxykaur-16-en-15-one
Common Name: ent-19-hydroxykaur-16-en-15-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O2/c1-13-14-5-6-16-19(3)9-4-8-18(2,12-21)15(19)7-10-20(16,11-14)17(13)22/h14-16,21H,1,4-12H2,2-3H3/t14-,15-,16+,18+,19-,20-/m1/s1
InChIKey: InChIKey=NYWYTVLBFMICLI-CCEQCLNRSA-N
Formula: C20H30O2
Molecular Weight: 302.45175
Exact Mass: 302.22458
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Boaventura, M.A.D., Hanson, J.R., Hitchcock, P.B., Takahashi, J.A. Phytochemistry (1994) 37, 387-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 39.7 |
| 2 (CH2) | 18.2 |
| 3 (CH2) | 35.5 |
| 4 (C) | 38.6 |
| 5 (CH) | 55.8 |
| 6 (CH2) | 18.8 |
| 7 (CH2) | 36.5 |
| 8 (C) | 52.4 |
| 9 (CH) | 52.7 |
| 10 (C) | 39.9 |
| 11 (CH2) | 17.9 |
| 12 (CH2) | 33.9 |
| 13 (CH) | 38.1 |
| 14 (CH2) | 32.3 |
| 15 (C) | 210.6 |
| 16 (C) | 149.5 |
| 17 (CH2) | 114.5 |
| 18 (CH3) | 26.9 |
| 19 (CH2) | 65.4 |
| 20 (CH3) | 17.9 |
