Spektraris NMR
6b-Acetoxy-1a,4a-dihydroxyeudesmane
Common Name: 6b-Acetoxy-1a,4a-dihydroxyeudesmane
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-SJRVDFGRSA-N
Formula: C17H30O4
Molecular Weight: 298.418353
Exact Mass: 298.214409
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Garcia-Granados, A., Gutierrez, M.C., Parra, A., Rivas, F. J Nat Prod (2002) 65, 1011-5
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) | 74.4 |
| 2 (CH2) | 27.1 |
| 3 (CH2) | 37.1 |
| 4 (C) | 71.7 |
| 5 (CH) | 49.8 |
| 6 (CH) | 70 |
| 7 (CH) | 49.8 |
| 8 (CH2) | 20.7 |
| 9 (CH2) | 37.3 |
| 10 (C) | 39.3 |
| 11 (CH) | 28.8 |
| 12 (CH3) | 21.7 |
| 13 (CH3) | 21.4 |
| 14 (CH3) | 20.7 |
| 15 (CH3) | 24.7 |
| 6a (C) | 172.3 |
| 6b (CH3) | 22 |
