Spektraris NMR
Elisapterosin E
Common Name: Elisapterosin E
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O4/c1-9-8-12-13-17(3,4)24-15-14(21)20(23)10(2)6-7-11(9)19(12,20)16(22)18(13,15)5/h9-13,15,23H,6-8H2,1-5H3/t9-,10-,11+,12-,13+,15+,18+,19+,20+/m0/s1
InChIKey: InChIKey=KNXYXOHODLWHAC-VPCHAZENSA-N
Formula: C20H28O4
Molecular Weight: 332.434679
Exact Mass: 332.198759
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Shi, Y.-P., Rodriguez, I., Rodriguez, A.D. Tetrahedron Lett (2003) 44, 3249-53
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Elisapteranes; 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 (C) | 63.2 |
| 2 (C) | 82.5 |
| 3 (CH) | 31.6 |
| 4 (CH2) | 27.5 |
| 5 (CH2) | 26.8 |
| 6 (CH) | 42.4 |
| 7 (CH) | 40.7 |
| 8 (CH2) | 41.2 |
| 9 (CH) | 40.2 |
| 10 (CH) | 62.7 |
| 11 (C) | 86.9 |
| 12 (CH3) | 26.5 |
| 13 (CH3) | 31.4 |
| 14 (C) | 212.1 |
| 15 (C) | 62.2 |
| 16 (CH) | 89.8 |
| 17 (C) | 204.5 |
| 18 (CH3) | 16.7 |
| 19 (CH3) | 21.2 |
| 20 (CH3) | 17.3 |
