Spektraris NMR
4beta,5alpha,10beta-Trihydroxycadinane
Common Name: 4beta,5alpha,10beta-Trihydroxycadinane
Synonyms: 4beta,5alpha,10beta-Trihydroxycadinane
CAS Registry Number:
InChI: InChI=1S/C15H28O3/c1-9(2)10-5-7-14(3,17)11-6-8-15(4,18)13(16)12(10)11/h9-13,16-18H,5-8H2,1-4H3/t10-,11+,12-,13-,14-,15-/m0/s1
InChIKey: InChIKey=MOTZIEZYHAAEBY-IWTMDLJTSA-N
Formula: C15H28O3
Molecular Weight: 256.381594
Exact Mass: 256.203845
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Kuo, Y.H., Chyu, C.F., Lin, H.C. Chem Pharm Bull (2003) 51, 986-9
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) | 41.8 |
| 2 (CH2) | 20.2 |
| 3 (CH2) | 32.4 |
| 4 (C) | 71.3 |
| 5 (CH) | 73 |
| 6 (CH) | 37.4 |
| 7 (CH) | 42.4 |
| 8 (CH2) | 19.1 |
| 9 (CH2) | 40.3 |
| 10 (C) | 70.9 |
| 11 (CH) | 25.7 |
| 12 (CH3) | 15.5 |
| 13 (CH3) | 21.5 |
| 14 (CH3) | 27.7 |
| 15 (CH3) | 28.8 |
