Spektraris NMR
seco-Asbestinin B
Common Name: seco-Asbestinin B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H34O6/c1-12-9-16-13(2)11-26-22(5,7-6-8-23)21-18(16)19(20(12)27-15(4)25)17(28-21)10-14(3)24/h8,12-13,16-21H,6-7,9-11H2,1-5H3/t12-,13+,16+,17+,18+,19+,20-,21+,22+/m1/s1
InChIKey: InChIKey=JCKGLZCOLJWKSN-HILCIDSOSA-N
Formula: C22H34O6
Molecular Weight: 394.502605
Exact Mass: 394.235539
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ospina, C.A., Rodriguez, A.D. J Nat Prod (2006) 69, 1721-7
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Asbestinanes; 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) | 38 |
| 2 (CH) | 92.5 |
| 3 (C) | 75.5 |
| 4 (CH2) | 28.3 |
| 5 (CH2) | 38.5 |
| 6 (CH) | 203.5 |
| 7 (C) | 206.8 |
| 8 (CH2) | 48.3 |
| 9 (CH) | 76.7 |
| 10 (CH) | 47.9 |
| 11 (CH) | 72.3 |
| 12 (CH) | 31.5 |
| 13 (CH2) | 30.8 |
| 14 (CH) | 37.7 |
| 15 (CH) | 36.5 |
| 16 (CH2) | 67.7 |
| 17 (CH3) | 11.2 |
| 18 (CH3) | 23.1 |
| 19 (CH3) | 30.7 |
| 20 (CH3) | 18.7 |
| 11a (C) | 171.1 |
| 11b (CH3) | 21.2 |
