Spektraris NMR
Dihydrolantadene-A
Common Name: Dihydrolantadene-A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C36H56O5/c1-11-22(2)29(38)41-28-21-31(3,4)20-24-23-12-13-26-33(7)16-15-27(37)32(5,6)25(33)14-17-35(26,9)34(23,8)18-19-36(24,28)30(39)40-10/h12,22,24-26,28H,11,13-21H2,1-10H3/t22-,24+,25+,26-,28-,33+,34-,35-,36+/m1/s1
InChIKey: InChIKey=YRSTWMACQKKNLD-SFWYQKNQSA-N
Formula: C36H56O5
Molecular Weight: 568.828199
Exact Mass: 568.412775
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Johns S.R., Lamberton L.A., Morton T.C., Suares H.C., Wiffin R.I. Aust J Chem (1983) 36, 1895-902
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Oleananes; 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) | 39.3 |
| 2 (CH2) | 34.2 |
| 3 (C) | 217.6 |
| 4 (C) | 47.5 |
| 5 (CH) | 55.4 |
| 6 (CH2) | 19.6 |
| 7 (CH2) | 32.3 |
| 8 (C) | 39.2 |
| 9 (CH) | 46.9 |
| 10 (C) | 36.8 |
| 11 (CH2) | 24.1 |
| 12 (CH) | 122.4 |
| 13 (C) | 143.3 |
| 14 (C) | 42 |
| 15 (CH2) | 27.7 |
| 16 (CH2) | 23.6 |
| 17 (C) | 50.7 |
| 18 (CH) | 38.8 |
| 19 (CH2) | 45.8 |
| 20 (C) | 30.1 |
| 21 (CH2) | 38.1 |
| 22 (CH) | 75.8 |
| 23 (CH3) | 26.5 |
| 24 (CH3) | 21.5 |
| 25 (CH3) | 15.1 |
| 26 (CH3) | 16.7 |
| 27 (CH3) | 25.8 |
| 28 (C) | 175.2 |
| 29 (CH3) | 33.8 |
| 30 (CH3) | 26.7 |
| 22a (C) | 174.3 |
| 22b (CH) | 41.3 |
| 22c (CH2) | 26.3 |
| 22d (CH3) | 11.7 |
| 22aa (CH3) | 16.7 |
| 28a (CH3) | 51.4 |
