Spektraris NMR
Elisabatin A
Common Name: Elisabatin A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H22O3/c1-9(2)6-13-7-10(3)15-14(21)8-11(4)16-18(15)17(13)12(5)19(22)20(16)23/h6,8,10,13,21H,7H2,1-5H3/t10-,13+/m0/s1
InChIKey: InChIKey=JVQJPMIBFYBOEO-GXFFZTMASA-N
Formula: C20H22O3
Molecular Weight: 310.387629
Exact Mass: 310.156895
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rodriguez, A.D., Ramirez, C., Rodriguez, II. J Nat Prod (1999) 62, 997-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Amphilectanes; 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) | 36.1 |
| 2 (CH2) | 33.7 |
| 3 (CH) | 26.3 |
| 4 (C) | 130.9 |
| 5 (C) | 160.5 |
| 6 (CH) | 119.2 |
| 7 (C) | 146.8 |
| 8 (C) | 122 |
| 9 (C) | 180.8 |
| 10 (C) | 182.6 |
| 11 (C) | 132.2 |
| 12 (C) | 153 |
| 13 (C) | 133.6 |
| 14 (CH) | 125.8 |
| 15 (C) | 132.5 |
| 16 (CH3) | 25.5 |
| 17 (CH3) | 17.6 |
| 18 (CH3) | 22.2 |
| 19 (CH3) | 23.8 |
| 20 (CH3) | 10.8 |
