Spektraris NMR
Atranones G
Common Name: Atranones G
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H34O8/c1-13(2)19-17-9-8-14(3)21(31-16(5)26)25(29)12-18(27)32-22(25)15(4)10-11-24(17,6)33-23(28)20(19)30-7/h8,13,17,21,29H,9-12H2,1-7H3/b14-8-,22-15+/t17-,21+,24+,25+/m1/s1
InChIKey: InChIKey=WSJAHUXFDVXVRY-QWFLWWJSSA-N
Formula: C25H34O8
Molecular Weight: 462.533622
Exact Mass: 462.225368
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Hinkley, S.F., Mazzola, E.P., Fettinger, J.C., Lam, Y.F., Jarvis, B.B. Phytochemistry (2000) 55, 663-73
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Dolabellanes; 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) | 85.7 |
| 2 (CH2) | 37.2 |
| 3 (CH2) | 23.5 |
| 4 (C) | 116.5 |
| 5 (C) | 149.7 |
| 6 (C) | 76.1 |
| 7 (CH) | 75.4 |
| 8 (C) | 132.6 |
| 9 (CH) | 134.3 |
| 10 (CH2) | 26.1 |
| 11 (CH) | 44.5 |
| 12 (C) | 147.1 |
| 13 (C) | 141 |
| 14 (C) | 161.1 |
| 15 (CH3) | 21.3 |
| 16 (CH3) | 16.5 |
| 17 (CH3) | 20.6 |
| 18 (CH) | 30.3 |
| 19 (CH3) | 20.3 |
| 20 (CH3) | 20.8 |
| 6a (CH2) | 40.9 |
| 6b (C) | 169.7 |
| 7a (C) | 171 |
| 7b (CH3) | 20.6 |
| 13a (CH3) | 59.4 |
