Spektraris NMR
Pseudopterosin T
Common Name: Pseudopterosin T
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C26H38O6/c1-11(2)9-16-10-13(4)17-8-7-12(3)18-20(17)19(16)14(5)25(22(18)28)32-26-24(30)23(29)21(27)15(6)31-26/h9,12-13,15-17,21,23-24,26-30H,7-8,10H2,1-6H3/t12-,13-,15-,16+,17+,21+,23+,24-,26-/m0/s1
InChIKey: InChIKey=LIAAPIYLHKRUNZ-ADEZWYPRSA-N
Formula: C26H38O6
Molecular Weight: 446.577312
Exact Mass: 446.266839
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rodriguez, II, Shi, Y.P., Garcia, O.J., Rodriguez, A.D., Mayer, A.M., Sanchez, J.A., Ortega-Barria, E., Gonzalez, J. J Nat Prod (2004) 67, 1672-80
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) | 37.3 |
| 2 (CH2) | 40.2 |
| 3 (CH) | 33.9 |
| 4 (CH) | 44.6 |
| 5 (CH2) | 27.8 |
| 6 (CH2) | 31.8 |
| 7 (CH) | 28.5 |
| 8 (C) | 126.9 |
| 9 (C) | 145.2 |
| 10 (C) | 143.3 |
| 11 (C) | 127.7 |
| 12 (C) | 129.2 |
| 13 (C) | 136.6 |
| 14 (CH) | 131.4 |
| 15 (C) | 128.2 |
| 16 (CH3) | 25.4 |
| 17 (CH3) | 17.5 |
| 18 (CH3) | 20.1 |
| 19 (CH3) | 23.2 |
| 20 (CH3) | 13.5 |
| 1' (CH) | 103 |
| 2' (CH) | 69.8 |
| 3' (CH) | 70.5 |
| 4' (CH) | 72.2 |
| 5' (CH) | 67.3 |
| 6' (CH3) | 16.2 |
