Spektraris NMR
Bonducellpin G
Common Name: Bonducellpin G
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H32O7/c1-12-15-8-10-29-17(15)11-16-19(12)20(27)21(31-14(3)26)24(28)22(4,5)9-7-18(23(16,24)6)30-13(2)25/h8,10,16,18-21,27-28H,1,7,9,11H2,2-6H3/t16-,18-,19-,20+,21-,23-,24+/m0/s1
InChIKey: InChIKey=IHXOABPCUNFFPZ-FRZBIBBKSA-N
Formula: C24H32O7
Molecular Weight: 432.5076
Exact Mass: 432.214803
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Pudhom, K., Sommit, D., Suwankitti, N., Petsom, A. J Nat Prod (2007) 70, 1542-4
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Vouacapanes; 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) | 76 |
| 2 (CH2) | 22.3 |
| 3 (CH2) | 32.5 |
| 4 (C) | 38.7 |
| 5 (C) | 79.4 |
| 6 (CH) | 77.6 |
| 7 (CH) | 72.6 |
| 8 (CH) | 45 |
| 9 (CH) | 38.1 |
| 10 (C) | 54 |
| 11 (CH2) | 23.2 |
| 12 (C) | 150.9 |
| 13 (C) | 120 |
| 14 (C) | 139.3 |
| 15 (CH) | 106.8 |
| 16 (CH) | 142.2 |
| 17 (CH2) | 107 |
| 18 (CH3) | 30.9 |
| 19 (CH3) | 25.2 |
| 20 (CH3) | 17.4 |
| 1a (C) | 169.3 |
| 1b (CH3) | 21.7 |
| 6a (C) | 172.2 |
| 6b (CH3) | 22.2 |
