Spektraris NMR
Elisapterosin A
Common Name: Elisapterosin A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O5/c1-9-8-12-13-16(3,4)25-20(24)15(22)19(23)10(2)6-7-11(9)18(12,19)14(21)17(13,20)5/h9-13,23-24H,6-8H2,1-5H3/t9-,10-,11+,12-,13+,17-,18+,19+,20+/m0/s1
InChIKey: InChIKey=QQNWLKBRRNMIGU-BABYDUTCSA-N
Formula: C20H28O5
Molecular Weight: 348.434084
Exact Mass: 348.193674
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rodriguez, A.D., Ramirez, C., Rodriguez, I., Barnes, C.L. J Org Chem (2000) 65, 1390-8
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) | 61.3 |
| 2 (C) | 81.7 |
| 3 (CH) | 38.3 |
| 4 (CH2) | 27.6 |
| 5 (CH2) | 23.3 |
| 6 (CH) | 43.6 |
| 7 (CH) | 42.8 |
| 8 (CH2) | 42 |
| 9 (CH) | 39.6 |
| 10 (CH) | 60.5 |
| 11 (C) | 84.6 |
| 12 (CH3) | 25.9 |
| 13 (CH3) | 30.6 |
| 14 (C) | 212.9 |
| 15 (C) | 62.1 |
| 16 (C) | 106 |
| 17 (C) | 209.9 |
| 18 (CH3) | 18.8 |
| 19 (CH3) | 18.1 |
| 20 (CH3) | 14.7 |
