Spektraris NMR
Granosolides A
Common Name: Granosolides A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H32O6/c1-13-6-7-19(26-15(3)23)22(5)10-8-16(14(2)20(25)28-22)12-18(24)21(4)11-9-17(13)27-21/h16-19,24H,1-2,6-12H2,3-5H3/t16-,17+,18-,19+,21-,22-/m1/s1
InChIKey: InChIKey=FKJVUNAVIADAQC-WEUXUUONSA-N
Formula: C22H32O6
Molecular Weight: 392.486723
Exact Mass: 392.219889
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Lu, Y., Huang, C.Y., Lin, Y.F., Wen, Z.H., Su, J.H., Kuo, Y.H., Chiang, M.Y., Sheu, J.H. J Nat Prod (2008) 71, 1754-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Cembranes; 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) | 32 |
| 2 (CH2) | 38 |
| 3 (CH) | 74.2 |
| 4 (C) | 86.1 |
| 5 (CH2) | 37.6 |
| 6 (CH2) | 28.7 |
| 7 (CH) | 81.3 |
| 8 (C) | 150.5 |
| 9 (CH2) | 31.7 |
| 10 (CH2) | 33.8 |
| 11 (CH) | 74.4 |
| 12 (C) | 87.4 |
| 13 (CH2) | 33.4 |
| 14 (CH2) | 29.2 |
| 15 (C) | 144.7 |
| 16 (C) | 169.2 |
| 17 (CH2) | 123.7 |
| 18 (CH3) | 17.9 |
| 19 (CH2) | 114.6 |
| 20 (CH3) | 23.8 |
| 11a (C) | 170.8 |
| 11b (CH3) | 21.2 |
