Spektraris NMR
1β,4β-Dihydroxy-6β-acetoxy-eudesmane
Common Name: 1β,4β-Dihydroxy-6β-acetoxy-eudesmane
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H30O4/c1-10(2)12-6-8-16(4)13(19)7-9-17(5,20)15(16)14(12)21-11(3)18/h10,12-15,19-20H,6-9H2,1-5H3/t12-,13+,14+,15+,16-,17-/m0/s1
InChIKey: InChIKey=PGMDYJUEXIFZJG-MDOLAMBHSA-N
Formula: C17H30O4
Molecular Weight: 298.418353
Exact Mass: 298.214409
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Garcia-Granados, A., Molina, A., Saenz de Buruaga, A., Saenz de Buruaga, J.M. Phytochemistry (1985) 24, 97-101
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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 (CH) | 80.3 |
| 2 (CH2) | 28.8 |
| 3 (CH2) | 40.8 |
| 4 (C) | 71.7 |
| 5 (CH) | 53 |
| 6 (CH) | 70.4 |
| 7 (CH) | 49.6 |
| 8 (CH2) | 21.2 |
| 9 (CH2) | 39.5 |
| 10 (C) | 39.4 |
| 11 (CH) | 29.6 |
| 12 (CH3) | 20.8 |
| 13 (CH3) | 21.6 |
| 14 (CH3) | 13.5 |
| 15 (CH3) | 20.5 |
| 8a (C) | 171.3 |
| 8b (CH3) | 21.8 |
