Spektraris NMR
Briarellin M
Common Name: Briarellin M
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H34O7/c1-11-13-6-8-21(4,28-12(2)23)17-14-10-20(3,26)15(24)7-9-22(5,29-19(11)25)18(27-14)16(13)17/h11,13-18,24,26H,6-10H2,1-5H3/t11-,13+,14+,15-,16+,17+,18+,20-,21-,22+/m1/s1
InChIKey: InChIKey=MATSVTSXOGSXAL-DZBBDLEOSA-N
Formula: C22H34O7
Molecular Weight: 410.50201
Exact Mass: 410.230453
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ospina, C.A., Rodriguez, A.D., Ortega-Barria, E., Capson, T.L. J Nat Prod (2003) 66, 357-63
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Eunicellanes; 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) | 44.5 |
| 2 (CH) | 94.9 |
| 3 (C) | 86.4 |
| 4 (CH2) | 35.2 |
| 5 (CH2) | 30.5 |
| 6 (CH) | 78.8 |
| 7 (C) | 76.3 |
| 8 (CH2) | 46.6 |
| 9 (CH) | 78.6 |
| 10 (CH) | 54.5 |
| 11 (C) | 81.7 |
| 12 (CH2) | 30 |
| 13 (CH2) | 16.9 |
| 14 (CH) | 38.2 |
| 15 (CH3) | 23.3 |
| 16 (CH3) | 22.5 |
| 17 (CH3) | 28.6 |
| 18 (CH) | 46.3 |
| 19 (CH3) | 17.7 |
| 20 (C) | 176.2 |
| 11a (C) | 169.4 |
| 11b (CH3) | 22.3 |
