Spektraris NMR
(11S)-1b,4a,6b,11,12-Pentahydroxyeudesmane
Common Name: (11S)-1b,4a,6b,11,12-Pentahydroxyeudesmane
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H28O5/c1-13-6-4-9(15(3,20)8-16)11(18)12(13)14(2,19)7-5-10(13)17/h9-12,16-20H,4-8H2,1-3H3/t9-,10-,11-,12-,13+,14-,15-/m1/s1
InChIKey: InChIKey=XNPUHXLIKQWVJE-KXPQCWJOSA-N
Formula: C15H28O5
Molecular Weight: 288.380404
Exact Mass: 288.193674
NMR Solvent: CD3OD
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) | 80.1 |
| 2 (CH2) | 28.3 |
| 3 (CH2) | 41.2 |
| 4 (C) | 72.1 |
| 5 (CH) | 55.7 |
| 6 (CH) | 66 |
| 7 (CH) | 49.3 |
| 8 (CH2) | 17.3 |
| 9 (CH2) | 41.9 |
| 10 (C) | 39.2 |
| 11 (C) | 74.9 |
| 12 (CH2) | 67.2 |
| 13 (CH3) | 23.8 |
| 14 (CH3) | 14.5 |
| 15 (CH3) | 24.3 |
