Spektraris NMR
Lucialdehyde D
Common Name: Lucialdehyde D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H42O4/c1-18(17-31)9-8-10-19(2)20-11-14-29(6)26-21(32)15-23-27(3,4)24(34)12-13-28(23,5)25(26)22(33)16-30(20,29)7/h9,17,19-20,23H,8,10-16H2,1-7H3/b18-9+/t19-,20-,23+,28+,29+,30-/m1/s1
InChIKey: InChIKey=KMWGWTNMXOQIAG-OLYQEQHRSA-N
Formula: C30H42O4
Molecular Weight: 466.653208
Exact Mass: 466.30831
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Niedermeyer, T.H., Lindequist, U., Mentel, R., Gordes, D., Schmidt, E., Thurow, K., Lalk, M. J Nat Prod (2005) 68, 1728-31
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Lanostanes; 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) | 35 |
| 2 (CH2) | 34.1 |
| 3 (C) | 215.5 |
| 4 (C) | 46.9 |
| 5 (CH) | 49.8 |
| 6 (CH2) | 37.1 |
| 7 (C) | 201.3 |
| 8 (C) | 151.5 |
| 9 (C) | 149.8 |
| 10 (C) | 38.8 |
| 11 (C) | 201.8 |
| 12 (CH2) | 51.2 |
| 13 (C) | 46.7 |
| 14 (C) | 48.7 |
| 15 (CH2) | 31.9 |
| 16 (CH2) | 27.43 |
| 17 (CH) | 49.1 |
| 18 (CH3) | 16.9 |
| 19 (CH3) | 17.9 |
| 20 (CH) | 36.1 |
| 21 (CH3) | 18.3 |
| 22 (CH2) | 34.5 |
| 23 (CH2) | 25.92 |
| 24 (CH) | 154.6 |
| 25 (C) | 139.4 |
| 26 (CH) | 195.2 |
| 27 (CH3) | 9.2 |
| 28 (CH3) | 27.44 |
| 29 (CH3) | 20.3 |
| 30 (CH3) | 25.87 |
