Spektraris NMR
Dictamnoside H
Common Name: Dictamnoside H
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H36O8/c1-10-5-6-13(23)21(4)8-7-11(20(2,3)27)18(14(10)21)29-19-17(26)16(25)15(24)12(9-22)28-19/h11-19,22-27H,1,5-9H2,2-4H3/t11-,12-,13+,14-,15-,16+,17-,18-,19+,21-/m1/s1
InChIKey: InChIKey=KQYUGTYAOSWTGY-VAKMVNQMSA-N
Formula: C21H36O8
Molecular Weight: 416.50656
Exact Mass: 416.241018
NMR Solvent: D2O
MHz:
Calibration:
NMR references: 13C - Chang, J., Xuan, L.J., Xu, Y.M., Zhang, J.S. J Nat Prod (2001) 64, 935-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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) | 82.4 |
| 2 (CH2) | 33.8 |
| 3 (CH2) | 37.6 |
| 4 (C) | 149.6 |
| 5 (CH) | 54.2 |
| 6 (CH) | 80.9 |
| 7 (CH) | 46.5 |
| 8 (CH2) | 20.8 |
| 9 (CH2) | 35.5 |
| 10 (C) | 42.3 |
| 11 (C) | 77 |
| 12 (CH3) | 31.3 |
| 13 (CH3) | 30.3 |
| 14 (CH3) | 17.5 |
| 15 (CH2) | 109.7 |
| 1' (CH) | 104.6 |
| 2' (CH) | 76 |
| 3' (CH) | 79 |
| 4' (CH) | 72 |
| 5' (CH) | 78.4 |
| 6' (CH2) | 63.1 |
