Spektraris NMR
9,13-Epoxylabda-14-ene-6beta,19-diol
Common Name: 9,13-Epoxylabda-14-ene-6beta,19-diol
Synonyms: 9,13-Epoxylabda-14-ene-6beta,19-diol
CAS Registry Number:
InChI: InChI=1S/C20H34O3/c1-6-18(4)10-11-20(23-18)14(2)12-15(22)16-17(3,13-21)8-7-9-19(16,20)5/h6,14-16,21-22H,1,7-13H2,2-5H3/t14-,15+,16-,17+,18-,19-,20+/m0/s1
InChIKey: InChIKey=SCNHUWHRMVPORA-HHBCTJDESA-N
Formula: C20H34O3
Molecular Weight: 322.482918
Exact Mass: 322.250795
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Roman, L.U., Cambron, J.I., del Rio, R.E., Hernandez, J.D., Cerda-Garcia-Rojas, C.M., Joseph-Nathan, P. J Nat Prod (2000) 63, 226-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : 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) | 37.6 |
| 2 (CH2) | 18 |
| 3 (CH2) | 36.5 |
| 4 (C) | 39.2 |
| 5 (CH) | 50.2 |
| 6 (CH) | 67.2 |
| 7 (CH2) | 41.2 |
| 8 (CH) | 39.5 |
| 9 (C) | 92.9 |
| 10 (C) | 41.8 |
| 11 (CH2) | 29.5 |
| 12 (CH2) | 34.9 |
| 13 (C) | 82.6 |
| 14 (CH) | 145 |
| 15 (CH2) | 110.6 |
| 16 (CH3) | 27.9 |
| 17 (CH3) | 19.8 |
| 18 (CH3) | 27 |
| 19 (CH2) | 68.8 |
| 20 (CH3) | 20.4 |
