Spektraris NMR
(4S)-10a,15-Epoxy-3a,14-dihydroxycadinane
Common Name: (4S)-10a,15-Epoxy-3a,14-dihydroxycadinane
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O3/c1-9-5-12-11(10(2)7-16)3-4-15(8-18-15)13(12)6-14(9)17/h9-14,16-17H,3-8H2,1-2H3/t9-,10+,11-,12-,13+,14+,15-/m0/s1
InChIKey: InChIKey=YKGDBJMTWPWZAG-DXETZELQSA-N
Formula: C15H26O3
Molecular Weight: 254.365713
Exact Mass: 254.188195
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Collins, D.O., Ruddock, P.L., Chiverton de Grasse, J., Reynolds, W.F., Reese, P.B. Phytochemistry (2002) 59, 479-88
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Cadinanes; 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) | 37.1 |
| 2 (CH2) | 32.5 |
| 3 (CH) | 69.6 |
| 4 (CH) | 35.8 |
| 5 (CH2) | 31.9 |
| 6 (CH) | 42.6 |
| 7 (CH) | 42.3 |
| 8 (CH2) | 23.7 |
| 9 (CH2) | 35 |
| 10 (C) | 61.2 |
| 11 (CH) | 34.4 |
| 12 (CH3) | 10.2 |
| 13 (CH2) | 67 |
| 14 (CH3) | 18.5 |
| 15 (CH2) | 49.9 |
