Spektraris NMR
15-Deoxoeucosterol
Common Name: 15-Deoxoeucosterol
Synonyms: 15-Deoxoeucosterol
CAS Registry Number:
InChI: InChI=1S/C29H46O4/c1-7-21(31)22-16-18(2)29(33-22)15-14-27(5)20-8-9-23-25(3,19(20)10-13-28(27,29)6)12-11-24(32)26(23,4)17-30/h18,22-24,30,32H,7-17H2,1-6H3/t18-,22+,23-,24+,25-,26-,27+,28+,29+/m1/s1
InChIKey: InChIKey=WKRCCXBCFBIWPN-KNRSYIFPSA-N
Formula: C29H46O4
Molecular Weight: 458.674235
Exact Mass: 458.33961
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Adinolfi, M., Corsaro, M.M., Lanzetta, R., Mancino, A., Mangoni, L., Parrilli, M. Phytochemistry (1993) 34, 773-8
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) | 35.43 |
| 2 (CH2) | 28.34 |
| 3 (CH) | 80.76 |
| 4 (C) | 42.8 |
| 5 (CH) | 51.25 |
| 6 (CH2) | 18.34 |
| 7 (CH2) | 26.5 |
| 8 (C) | 134.15 |
| 9 (C) | 135.22 |
| 10 (C) | 36.19 |
| 11 (CH2) | 20.17 |
| 12 (CH2) | 24.94 |
| 13 (C) | 48.63 |
| 14 (C) | 50.57 |
| 15 (CH2) | 31.74 |
| 16 (CH2) | 39.7 |
| 17 (C) | 91.17 |
| 18 (CH3) | 19.22 |
| 19 (CH3) | 19.89 |
| 20 (CH) | 43.58 |
| 21 (CH3) | 17.18 |
| 22 (CH2) | 36.79 |
| 23 (CH) | 81.44 |
| 24 (C) | 213.54 |
| 25 (CH2) | 32.32 |
| 26 (CH3) | 7.41 |
| 28 (CH3) | 22.32 |
| 29 (CH2) | 64.35 |
| 30 (CH3) | 25.82 |
