Spektraris NMR
Taibaihenryiin B
Common Name: Taibaihenryiin B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O6/c1-9-10-6-11(21)13-18-5-4-12(22)17(2,3)14(18)16(24)20(25,26-8-18)19(13,7-10)15(9)23/h10-14,16,21-22,24-25H,1,4-8H2,2-3H3/t10-,11-,12+,13+,14-,16+,18-,19+,20-/m1/s1
InChIKey: InChIKey=NGTJHRUNHBCVEM-SAKXKXTDSA-N
Formula: C20H28O6
Molecular Weight: 364.433489
Exact Mass: 364.188589
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Li, B.L., Pan, Y.J., Pan, W.J. Helv Chim Acta (2001) 84, 3418-22
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 39 |
| 2 (CH2) | 34 |
| 3 (CH) | 74.4 |
| 4 (C) | 34.1 |
| 5 (CH) | 60.9 |
| 6 (CH) | 72.7 |
| 7 (C) | 95.7 |
| 8 (C) | 59.3 |
| 9 (CH) | 54.3 |
| 10 (C) | 42.5 |
| 11 (CH) | 66.5 |
| 12 (CH2) | 39.1 |
| 13 (CH) | 34.2 |
| 14 (CH2) | 26.6 |
| 15 (C) | 211.3 |
| 16 (C) | 154.1 |
| 17 (CH2) | 116.1 |
| 18 (CH3) | 28.9 |
| 19 (CH3) | 22.8 |
| 20 (CH2) | 65.1 |
