Spektraris NMR
19(4->3)abeo-8a,13(S)-Epoxylabda-4(18),14-diene
Common Name: 19(4->3)abeo-8a,13(S)-Epoxylabda-4(18),14-diene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O/c1-7-18(4)11-10-17-19(5)12-8-14(2)15(3)16(19)9-13-20(17,6)21-18/h7,14,16-17H,1,3,8-13H2,2,4-6H3/t14-,16?,17?,18-,19+,20-/m1/s1
InChIKey: InChIKey=SMOMBYDUUJOWKC-XTFPUYFESA-N
Formula: C20H32O1
Molecular Weight: 288.468227
Exact Mass: 288.245316
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Kinouchi, Y., Ohtsu, H., Tokuda, H., Nishino, H., Matsunaga, S., Tanaka, R. J Nat Prod (2000) 63, 817-20
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abeo-Labdanes; 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) | 34 |
| 2 (CH2) | 28.5 |
| 3 (CH) | 38.2 |
| 4 (C) | 154.7 |
| 5 (CH) | 46.4 |
| 6 (CH2) | 22.5 |
| 7 (CH2) | 41.7 |
| 8 (C) | 76 |
| 9 (CH) | 56.6 |
| 10 (C) | 39.3 |
| 11 (CH2) | 16.5 |
| 12 (CH2) | 35 |
| 13 (C) | 73.5 |
| 15 (CH) | 147.7 |
| 16 (CH2) | 109.5 |
| 17 (CH3) | 23.8 |
| 18 (CH2) | 105.1 |
| 19 (CH3) | 32.7 |
| 20 (CH3) | 20.4 |
| 21 (CH3) | 12.4 |
