Spektraris NMR
Bafoudiosbulbins F
Common Name: Bafoudiosbulbins F
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H24O8/c1-19-9-14(11-3-6-27-10-11)29-18(24)21(19,25)5-4-20-13(16(22)26-2)7-12(8-15(19)20)28-17(20)23/h3,6,10,12-15,25H,4-5,7-9H2,1-2H3/t12-,13+,14-,15-,19-,20+,21+/m0/s1
InChIKey: InChIKey=YPRSTWCOPJVVJE-UXJQWXQXSA-N
Formula: C21H24O8
Molecular Weight: 404.411271
Exact Mass: 404.147118
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Youngsa-ad, W., Ngamrojanavanich, N., Mahidol, C., Ruchirawat, S., Prawat, H., Kittakoop, P. Planta Med (2007) 73, 1491-4
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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 (CH2) | 27 |
| 2 (CH) | 73.6 |
| 3 (CH2) | 29.1 |
| 4 (CH) | 41.7 |
| 5 (C) | 42.9 |
| 6 (CH2) | 25.5 |
| 7 (CH2) | 27 |
| 8 (C) | 74.7 |
| 9 (C) | 39.3 |
| 10 (CH) | 38 |
| 11 (CH2) | 34.9 |
| 12 (CH) | 70.5 |
| 13 (C) | 125.6 |
| 14 (CH) | 109.5 |
| 15 (CH) | 144.3 |
| 16 (CH) | 140.9 |
| 17 (C) | 171.9 |
| 18 (C) | 172.6 |
| 19 (C) | 176.9 |
| 20 (CH3) | 17.4 |
| 18a (CH3) | 52.8 |
