Spektraris NMR
6β-Acetoxy-4a-hydroxyeudesm-11-en-1-one
Common Name: 6β-Acetoxy-4a-hydroxyeudesm-11-en-1-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H26O4/c1-10(2)12-6-8-16(4)13(19)7-9-17(5,20)15(16)14(12)21-11(3)18/h12,14-15,20H,1,6-9H2,2-5H3/t12-,14+,15+,16-,17+/m0/s1
InChIKey: InChIKey=BTUOEEKCFWGMGB-BYHHXJKWSA-N
Formula: C17H26O4
Molecular Weight: 294.38659
Exact Mass: 294.183109
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 (C) | 214.8 |
| 2 (CH2) | 35.5 |
| 3 (CH2) | 40.5 |
| 4 (C) | 70.8 |
| 5 (CH) | 54.4 |
| 6 (CH) | 69 |
| 7 (CH) | 49.9 |
| 8 (CH2) | 21 |
| 9 (CH2) | 35.3 |
| 10 (C) | 46.9 |
| 11 (C) | 145.7 |
| 12 (CH2) | 111.3 |
| 13 (CH3) | 23 |
| 14 (CH3) | 20.8 |
| 15 (CH3) | 25.1 |
| 6a (C) | 171.1 |
| 6b (CH3) | 21.5 |
