Spektraris NMR
9α-Hydroxy-2-epi-16-deoxysarcophine
Common Name: 9α-Hydroxy-2-epi-16-deoxysarcophine
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O3/c1-13-5-8-16-15(3)12-22-17(16)11-14(2)7-10-19-20(4,23-19)18(21)9-6-13/h6,11,17-19,21H,5,7-10,12H2,1-4H3/b13-6+,14-11+/t17-,18+,19+,20+/m1/s1
InChIKey: InChIKey=YCFWYGHHOGCWPB-LQROGWRGSA-N
Formula: C20H30O3
Molecular Weight: 318.451155
Exact Mass: 318.219495
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Sawant, S.S., Youssef, D.T., Reiland, J., Ferniz, M., Marchetti, D., El Sayed, K.A. J Nat Prod (2006) 69, 1010-3
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Cembranes; 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) | 133.6 |
| 2 (CH) | 85.3 |
| 3 (CH) | 125.5 |
| 4 (C) | 140.2 |
| 5 (CH2) | 34.7 |
| 6 (CH2) | 27 |
| 7 (CH) | 62.1 |
| 8 (C) | 63.4 |
| 9 (CH) | 78.8 |
| 10 (CH2) | 31.5 |
| 11 (CH) | 118.2 |
| 12 (C) | 138.9 |
| 13 (CH2) | 39.2 |
| 14 (CH2) | 28.9 |
| 15 (C) | 128.2 |
| 16 (CH2) | 78.5 |
| 17 (CH3) | 10.5 |
| 18 (CH3) | 17.8 |
| 19 (CH3) | 10 |
| 20 (CH3) | 15.5 |
