Spektraris NMR
Briarlide R
Common Name: Briarlide R
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C26H34O10/c1-12-10-17(32-14(3)27)21(30)24(6)18(33-15(4)28)9-8-13(2)20(24)22(34-16(5)29)26-19(11-12)35-23(31)25(26,7)36-26/h8,11,17-22,30H,9-10H2,1-7H3/b12-11-/t17-,18+,19+,20-,21+,22+,24+,25+,26+/m1/s1
InChIKey: InChIKey=SDXGSKBELNGLDU-HCUSGAKRSA-N
Formula: C26H34O10
Molecular Weight: 506.543168
Exact Mass: 506.215197
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Iwagawa, T., Nishitani, N., Nakatani, M., Doe, M., Morimoto, Y., Takemura, K. J Nat Prod (2005) 68, 31-5
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Briaranes; 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 (C) | 45.7 |
| 2 (CH) | 71.7 |
| 3 (CH) | 72 |
| 4 (CH2) | 34.4 |
| 5 (C) | 140.3 |
| 6 (CH) | 120.4 |
| 7 (CH) | 74.8 |
| 8 (C) | 71.1 |
| 9 (CH) | 68 |
| 10 (CH) | 44.4 |
| 11 (C) | 133.4 |
| 12 (CH) | 120.1 |
| 13 (CH2) | 26.3 |
| 14 (CH) | 74.2 |
| 15 (CH3) | 13.3 |
| 16 (CH3) | 27.2 |
| 17 (C) | 64 |
| 18 (CH3) | 9.8 |
| 19 (C) | 170.9 |
| 20 (CH3) | 24.6 |
| 3a (C) | 169.2 |
| 3b (CH3) | 21 |
| 9a (C) | 169.6 |
| 9b (CH3) | 21.2 |
| 14a (C) | 170.8 |
| 14b (CH3) | 21.2 |
