Spektraris NMR
Hanagokenols B
Common Name: Hanagokenols B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H26O5/c1-11(2)12-8-13(17(22)23)14(9-15(12)21)20(4)7-5-6-19(3)10-25-18(24)16(19)20/h8-9,11,16,21H,5-7,10H2,1-4H3,(H,22,23)/t16-,19-,20+/m0/s1
InChIKey: InChIKey=XEYFSNHIPLMFRB-FFZOFVMBSA-N
Formula: C20H26O5
Molecular Weight: 346.418202
Exact Mass: 346.178024
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Yoshikawa, K., Kokudo, N., Tanaka, M., Nakano, T., Shibata, H., Aragaki, N., Higuchi, T., Hashimoto, T. Chem Pharm Bull (2008) 56, 89-92
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abietanes; 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 (CH2) | 38.5 |
| 2 (CH2) | 18.8 |
| 3 (CH2) | 33.8 |
| 4 (C) | 42.7 |
| 5 (CH) | 56.6 |
| 6 (C) | 177.3 |
| 7 (C) | 173.7 |
| 8 (C) | 123.9 |
| 9 (C) | 143.8 |
| 10 (C) | 38.8 |
| 11 (CH) | 115.7 |
| 12 (C) | 154.7 |
| 13 (C) | 132.8 |
| 14 (CH) | 128.8 |
| 15 (CH) | 26.7 |
| 16 (CH3) | 22.2 |
| 17 (CH3) | 22.2 |
| 18 (CH2) | 81.8 |
| 19 (CH3) | 20.5 |
| 20 (CH3) | 20.7 |
