Spektraris NMR
Pseudopterosin F
Common Name: Pseudopterosin F
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H36O6/c1-11(2)8-15-9-13(4)16-7-6-12(3)18-20(16)19(15)14(5)24(22(18)28)31-25-23(29)21(27)17(26)10-30-25/h8,12-13,15-17,21,23,25-29H,6-7,9-10H2,1-5H3/t12-,13-,15-,16+,17+,21+,23-,25+/m0/s1
InChIKey: InChIKey=MWZXYPPIOWWIFA-AAWCYTKOSA-N
Formula: C25H36O6
Molecular Weight: 432.550694
Exact Mass: 432.251189
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Roussis, V., Wu, Z., Fenical, W., Strobel, S.A., Duyne, G.D.V., Clardy, J. J Org Chem (1990) 55, 4916-22
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) | 35.2 |
| 2 (CH2) | 39.2 |
| 3 (CH) | 29.7 |
| 4 (CH) | 42.9 |
| 5 (CH2) | 27.9 |
| 6 (CH2) | 30.3 |
| 7 (CH) | 26.9 |
| 8 (C) | 127.1 |
| 9 (C) | 144.6 |
| 10 (C) | 142.1 |
| 11 (C) | 126.7 |
| 12 (C) | 128.2 |
| 13 (C) | 134.2 |
| 14 (CH) | 130.2 |
| 15 (C) | 129 |
| 16 (CH3) | 24.9 |
| 17 (CH3) | 16.9 |
| 18 (CH3) | 20.4 |
| 19 (CH3) | 22.2 |
| 20 (CH3) | 11.5 |
| 1' (CH) | 104.1 |
| 2' (CH) | 68.9 |
| 3' (CH) | 68.9 |
| 4' (CH) | 68.7 |
| 5' (CH2) | 63.8 |
