Spektraris NMR
Asbestinin-25
Common Name: Asbestinin-25
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C23H38O6/c1-12-9-15-13(2)11-27-23(5)8-7-17(26-6)22(4,25)10-16-19(18(15)21(23)29-16)20(12)28-14(3)24/h12-13,15-21,25H,7-11H2,1-6H3/t12-,13+,15+,16+,17-,18+,19+,20-,21+,22-,23+/m1/s1
InChIKey: InChIKey=SHHCCZSDXWGINH-VPDVHZRNSA-N
Formula: C23H38O6
Molecular Weight: 410.545104
Exact Mass: 410.266839
NMR Solvent: C5D5N
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) | 37.7 |
| 2 (CH) | 92.5 |
| 3 (C) | 77.7 |
| 4 (CH2) | 34.6 |
| 5 (CH2) | 27 |
| 6 (CH) | 85.8 |
| 7 (C) | 75.3 |
| 8 (CH2) | 47.6 |
| 9 (CH) | 79.6 |
| 10 (CH) | 48.7 |
| 11 (CH) | 73.4 |
| 12 (CH) | 31.7 |
| 13 (CH2) | 31.4 |
| 14 (CH) | 38.6 |
| 15 (CH) | 37.1 |
| 16 (CH2) | 67.9 |
| 17 (CH3) | 11.4 |
| 18 (CH3) | 22.6 |
| 19 (CH3) | 24.2 |
| 20 (CH3) | 17.4 |
| 6a (CH3) | 57.7 |
| 11a (C) | 171 |
| 11b (CH3) | 21.2 |
