Spektraris NMR
18-Hydroxyhugorosenone
Common Name: 18-Hydroxyhugorosenone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O3/c1-5-18(2)8-9-19(3)13(11-18)6-7-14-15(19)10-16(22)17(23)20(14,4)12-21/h5,10,13-14,17,21,23H,1,6-9,11-12H2,2-4H3/t13-,14-,17+,18-,19-,20+/m1/s1
InChIKey: InChIKey=MTAGALXGQXZRRV-SUKDQFRTSA-N
Formula: C20H30O3
Molecular Weight: 318.451155
Exact Mass: 318.219495
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Mdee, L.K., Waibel, R., Nkunya, M.H.H., Jonker, S.A., Achenbach, H. Phytochemistry (1998) 49, 1107-13
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Rosanes; 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) | 119.4 |
| 2 (C) | 200.2 |
| 3 (CH) | 75.7 |
| 4 (C) | 48.2 |
| 5 (CH) | 38.5 |
| 6 (CH2) | 14.1 |
| 7 (CH2) | 24.5 |
| 8 (CH) | 30.7 |
| 9 (C) | 39 |
| 10 (C) | 177.5 |
| 11 (CH2) | 34.2 |
| 12 (CH2) | 39.5 |
| 13 (C) | 36.1 |
| 14 (CH2) | 32.4 |
| 15 (CH) | 150.4 |
| 16 (CH2) | 109.3 |
| 17 (CH3) | 22.2 |
| 18 (CH2) | 64.7 |
| 19 (CH3) | 9.3 |
| 20 (CH3) | 19 |
