Spektraris NMR
Saudinolide
Common Name: Saudinolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H20O8/c1-10-13(21)25-12-4-6-16(2)14(22)26-15-20(16)17(12,3)18(10,23)9-19(27-15,28-20)11-5-7-24-8-11/h4-8,10,12,15,23H,9H2,1-3H3/t10-,12-,15+,16-,17-,18+,19-,20-/m1/s1
InChIKey: InChIKey=MZXLSBRDPNLQNB-RUEPBKSJSA-N
Formula: C20H20O8
Molecular Weight: 388.368772
Exact Mass: 388.115818
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Mossa, J.S., Muhammad, I., AlYahya, M.A., Mirza, H.H., ElFeraly, F.S., McPhail, A.T. J Nat Prod (1996) 59, 224-31
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) | 73 |
| 3 (C) | 172.7 |
| 4 (CH) | 47.7 |
| 5 (C) | 72.5 |
| 6 (CH2) | 42.3 |
| 7 (C) | 108.4 |
| 9 (C) | 89.7 |
| 10 (CH) | 100.6 |
| 12 (C) | 174.7 |
| 13 (C) | 44.3 |
| 14 (CH) | 126.2 |
| 15 (CH) | 132.3 |
| 16 (C) | 48.8 |
| 17 (CH3) | 15.5 |
| 18 (CH3) | 19.6 |
| 19 (CH3) | 16.5 |
| 2' (CH) | 141.9 |
| 3' (C) | 124.3 |
| 4' (CH) | 108.7 |
| 5' (CH) | 144.4 |
