Spektraris NMR
Tubipolide A
Common Name: Tubipolide A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H22O6/c1-10(18)15(21)17(22)7-13-12(9-23-11(2)19)5-4-6-16(13,3)8-14(17)20/h4-6,13,15,21-22H,7-9H2,1-3H3/t13-,15?,16-,17-/m0/s1
InChIKey: InChIKey=JIUVKCBCJDBPJJ-ZIDRKRCISA-N
Formula: C17H22O6
Molecular Weight: 322.353636
Exact Mass: 322.141638
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Duh, C.Y., Chen, K.J., El-Gamal, A.A., Dai, C.F. J Nat Prod (2001) 64, 1430-3
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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) | 134.4 |
| 2 (CH) | 123.5 |
| 3 (CH) | 121.6 |
| 4 (C) | 135.3 |
| 5 (CH) | 40.3 |
| 6 (CH2) | 38.2 |
| 7 (C) | 80.7 |
| 8 (C) | 207.7 |
| 9 (CH2) | 49.3 |
| 10 (C) | 42.4 |
| 11 (CH) | 78.7 |
| 12 (C) | 206.2 |
| 13 (CH3) | 28 |
| 14 (CH3) | 25.7 |
| 15 (CH2) | 66.3 |
| 15a (C) | 171 |
| 15b (CH3) | 21 |
