Spektraris NMR
19-hydroxy- 8(9), 13( 16)- 14S, 17-cyclolabdadiene
Common Name: 19-hydroxy- 8(9), 13( 16)- 14S, 17-cyclolabdadiene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O/c1-14-6-8-17-16(12-15(14)2)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h15,18,21H,1,5-13H2,2-4H3/t15-,18-,19+,20+/m0/s1
InChIKey: InChIKey=IKNLTNZCCJZSAP-KCUHQSDYSA-N
Formula: C20H32O1
Molecular Weight: 288.468227
Exact Mass: 288.245316
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Pinto, A.C., Rezende, C.M., Antunes, O.A.C., Correia, C.R.D. Phytochemistry (1996) 42, 767-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Miscellanea; 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) | 35.4 |
| 2 (CH2) | 18.7 |
| 3 (CH2) | 36.4 |
| 4 (C) | 38.7 |
| 5 (CH) | 52.8 |
| 6 (CH2) | 19.8 |
| 7 (CH2) | 35.7 |
| 8 (C) | 130 |
| 9 (C) | 143.2 |
| 10 (C) | 38.7 |
| 11 (CH2) | 27.2 |
| 12 (CH2) | 34 |
| 13 (C) | 157.1 |
| 14 (CH) | 38.8 |
| 15 (CH2) | 18.6 |
| 16 (CH2) | 107.2 |
| 17 (CH3) | 40.7 |
| 18 (CH3) | 26.7 |
| 19 (CH2) | 65.6 |
| 20 (CH3) | 19.9 |
