Spektraris NMR
Euphoractine E
Common Name: Euphoractine E
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C29H36O5/c1-16-15-18-21(23(16)31)25(33)28(4)14-13-19-22(27(19,2)3)26(29(28,5)24(18)32)34-20(30)12-11-17-9-7-6-8-10-17/h6-12,16,19,22-23,25-26,31,33H,13-15H2,1-5H3/b12-11+/t16-,19-,22-,23-,25+,26+,28-,29-/m0/s1
InChIKey: InChIKey=HKPWYRCJCZALNK-RWZDKYSZSA-N
Formula: C29H36O5
Molecular Weight: 464.594233
Exact Mass: 464.256274
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Shi, J.G., Jia, Z.J. Phytochemistry (1995) 38, 1445-7
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Miscellanea; 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) | 35.4 |
| 2 (CH) | 35.8 |
| 3 (CH) | 78.3 |
| 4 (C) | 157.5 |
| 5 (CH) | 65 |
| 6 (C) | 47.6 |
| 7 (CH2) | 32.7 |
| 8 (CH2) | 19.9 |
| 9 (CH) | 25 |
| 10 (C) | 21.2 |
| 11 (CH) | 29.5 |
| 12 (CH) | 71 |
| 13 (C) | 60.7 |
| 14 (C) | 199.1 |
| 15 (C) | 137.7 |
| 16 (CH3) | 15.9 |
| 17 (CH3) | 18.1 |
| 18 (CH3) | 28.4 |
| 19 (CH3) | 13.6 |
| 20 (CH3) | 11.9 |
| 12a (C) | 166 |
| 12b (CH) | 118.9 |
| 12c (CH) | 145.8 |
| 12d (C) | 134.2 |
| 12e (CH) | 128.8 |
| 12f (CH) | 128.1 |
| 12g (CH) | 130.5 |
| 12h (CH) | 128.1 |
| 12i (CH) | 128.8 |
