Spektraris NMR
Dendromoniliside C
Common Name: Dendromoniliside C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H32O10/c1-7(2)11-12-8-4-10(30-19-15(25)14(24)13(23)9(5-22)29-19)21(6-28-21)20(8,3)17(26)16(11)31-18(12)27/h7-17,19,22-26H,4-6H2,1-3H3/t8-,9-,10+,11-,12+,13-,14+,15-,16+,17+,19+,20-,21-/m1/s1
InChIKey: InChIKey=VDOXHFZQCMWZFW-MZUJOSMLSA-N
Formula: C21H32O10
Molecular Weight: 444.473607
Exact Mass: 444.199547
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Zhao, C., Liu, Q., Halaweish, F., Shao, B., Ye, Y., Zhao, W. J Nat Prod (2003) 66, 1140-3
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Picrotoxanes; 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) | 43.3 |
| 2 (CH) | 75.4 |
| 3 (CH) | 83.8 |
| 4 (CH) | 52.2 |
| 5 (CH) | 45.9 |
| 6 (CH) | 43.1 |
| 7 (CH3) | 27 |
| 8 (CH) | 25 |
| 9 (CH3) | 19.7 |
| 10 (CH3) | 20.5 |
| 11 (CH2) | 34.4 |
| 12 (CH) | 82.5 |
| 13 (C) | 75 |
| 14 (CH2) | 51 |
| 15 (C) | 179.1 |
| 1' (CH) | 103.5 |
| 2' (CH) | 75 |
| 3' (CH) | 78.5 |
| 4' (CH) | 71.2 |
| 5' (CH) | 78.3 |
| 6' (CH2) | 62.1 |
