Spektraris NMR
6β-Acetoxy-11,12-epoxy-4β-hydroxyeudesman-1-one
Common Name: 6β-Acetoxy-11,12-epoxy-4β-hydroxyeudesman-1-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H26O5/c1-10(18)22-13-11(17(4)9-21-17)5-7-15(2)12(19)6-8-16(3,20)14(13)15/h11,13-14,20H,5-9H2,1-4H3/t11-,13-,14-,15+,16+,17?/m1/s1
InChIKey: InChIKey=AZCDEYVPRTYQFA-KUAVOOOBSA-N
Formula: C17H26O5
Molecular Weight: 310.385994
Exact Mass: 310.178024
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) | 215.2 |
| 2 (CH2) | 34.3 |
| 3 (CH2) | 42.1 |
| 4 (C) | 71.7 |
| 5 (CH) | 53.5 |
| 6 (CH) | 70.2 |
| 7 (CH) | 47.2 |
| 8 (CH2) | 17.6 |
| 9 (CH2) | 33.7 |
| 10 (C) | 48.1 |
| 11 (C) | 56.8 |
| 12 (CH2) | 51.3 |
| 13 (CH3) | 21.2 |
| 14 (CH3) | 21.1 |
| 15 (CH3) | 29.3 |
| 6a (C) | 170.8 |
| 6b (CH3) | 21.8 |
