Spektraris NMR
3-Epiglochidiol
Common Name: 3-Epiglochidiol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H50O2/c1-18(2)19-11-13-27(5)15-16-28(6)20(25(19)27)9-10-22-29(28,7)14-12-21-26(3,4)23(31)17-24(32)30(21,22)8/h19-25,31-32H,1,9-17H2,2-8H3/t19-,20+,21-,22-,23-,24+,25+,27+,28+,29+,30-/m0/s1
InChIKey: InChIKey=SWEUJTWPRYKNNX-AXLUDCLJSA-N
Formula: C30H50O2
Molecular Weight: 442.717924
Exact Mass: 442.381081
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Savona G., Bruno M., Rodriguez B., Marco J.L. Phytochemistry (1987) 26, 3305
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Lupanes; 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 (CH) | 79 |
| 2 (CH2) | 37.5 |
| 3 (CH) | 75.7 |
| 4 (C) | 38.9 |
| 5 (CH) | 53.1 |
| 6 (CH2) | 18 |
| 7 (CH2) | 34.1 |
| 8 (C) | 41.3 |
| 9 (CH) | 51.4 |
| 10 (C) | 43.5 |
| 11 (CH2) | 23.8 |
| 12 (CH2) | 25 |
| 13 (CH) | 38 |
| 14 (C) | 42.8 |
| 15 (CH2) | 27.4 |
| 16 (CH2) | 35.5 |
| 17 (C) | 42.9 |
| 18 (CH) | 48.3 |
| 19 (CH) | 47.9 |
| 20 (C) | 150.8 |
| 21 (CH2) | 29.7 |
| 22 (CH2) | 39.9 |
| 23 (CH3) | 27.8 |
| 24 (CH3) | 14.9 |
| 25 (CH3) | 11.9 |
| 26 (CH3) | 16.2 |
| 27 (CH3) | 14.4 |
| 28 (CH3) | 18 |
| 29 (CH2) | 109.4 |
| 30 (CH3) | 19.2 |
