Spektraris NMR
Oleanderen
Common Name: Oleanderen
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H50/c1-20-12-16-27(5)18-19-29(7)22(25(27)21(20)2)10-11-24-28(6)15-9-14-26(3,4)23(28)13-17-30(24,29)8/h10,20-21,23-25H,9,11-19H2,1-8H3/t20-,21+,23+,24-,25+,27-,28+,29-,30-/m1/s1
InChIKey: InChIKey=DGXIUFDVYPIXCI-XRBCGWODSA-N
Formula: C30H50
Molecular Weight: 410.719115
Exact Mass: 410.391252
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Siddiqui S., Siddiqui B.S., Hafeez F., Begwn S. Planta Med (1988) 54, 232
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Ursanes; 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) | 39.9 |
| 2 (CH2) | 19.2 |
| 3 (CH2) | 42.2 |
| 4 (C) | 33.1 |
| 5 (CH) | 56.4 |
| 6 (CH2) | 19.7 |
| 7 (CH2) | 32.8 |
| 8 (C) | 39.4 |
| 9 (CH) | 47.7 |
| 10 (C) | 37.1 |
| 11 (CH2) | 17.4 |
| 12 (CH) | 127.5 |
| 13 (C) | 139.3 |
| 14 (C) | 42.4 |
| 15 (CH2) | 28.8 |
| 16 (CH2) | 26.5 |
| 17 (C) | 33.8 |
| 18 (CH) | 58.9 |
| 19 (CH) | 39 |
| 20 (CH) | 39.1 |
| 21 (CH2) | 31.2 |
| 22 (CH2) | 41 |
| 23 (CH3) | 33.4 |
| 24 (CH3) | 21.7 |
| 25 (CH3) | 16.5 |
| 26 (CH3) | 16.8 |
| 27 (CH3) | 24.5 |
| 28 (CH3) | 28.1 |
| 29 (CH3) | 22.9 |
| 30 (CH3) | 21.1 |
