Spektraris NMR
Ent-16-hydroxycleroda-4(18),13-dien-15,16-olide
Common Name: Ent-16-hydroxycleroda-4(18),13-dien-15,16-olide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O3/c1-13-6-5-7-16-19(13,3)10-8-14(2)20(16,4)11-9-15-12-17(21)23-18(15)22/h12,14,16,18,22H,1,5-11H2,2-4H3/t14-,16+,18?,19+,20+/m0/s1
InChIKey: InChIKey=OSIVSEZZEFZSDB-YTYPLSIXSA-N
Formula: C20H30O3
Molecular Weight: 318.451155
Exact Mass: 318.219495
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ide, R.M., Costab, M., Imamura, P.M. J. J Braz Chem Soc (2006) 17, 417-20
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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) | 21.3 |
| 2 (CH2) | 28.6 |
| 3 (CH2) | 32.9 |
| 4 (C) | 160.2 |
| 5 (C) | 40 |
| 6 (CH2) | 37.2 |
| 7 (CH2) | 27.3 |
| 8 (CH) | 36.7 |
| 9 (C) | 39.2 |
| 10 (CH) | 48.7 |
| 11 (CH2) | 34.7 |
| 12 (CH2) | 21.7 |
| 13 (C) | 170.4 |
| 14 (CH) | 117 |
| 15 (C) | 171.5 |
| 16 (CH) | 99 |
| 17 (CH3) | 16 |
| 18 (CH2) | 102.8 |
| 19 (CH3) | 20.8 |
| 20 (CH3) | 18 |
