Spektraris NMR
1-(α-Ribofuranosyl)-lumichrome
Common Name: 1-(α-Ribofuranosyl)-lumichrome
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H18N4O6/c1-6-3-8-9(4-7(6)2)19-14-11(18-8)15(25)20-17(26)21(14)16-13(24)12(23)10(5-22)27-16/h3-4,10,12-13,16,22-24H,5H2,1-2H3,(H,20,25,26)/t10-,12-,13-,16+/m1/s1
InChIKey: InChIKey=GABBHVWWVWVMCN-VSBTWAGUSA-N
Formula: C17H17N4O6
Molecular Weight: 373.340905
Exact Mass: 373.114809
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Stroch, K., Zeeck, A., Antal, N., Fiedler, H.P. J Antibiot (2005) 58, 103-10
Species:
Notes: Family : Alkaloids, Type : Pyrimidin-Quinoxalines; 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 |
|---|---|
| 2 (C) | 157 |
| 4 (C) | 169.2 |
| 4a (C) | 142.7 |
| 5a (C) | 139.7 |
| 6 (CH) | 129.2 |
| 7 (C) | 143.2 |
| 8 (C) | 145.1 |
| 9 (CH) | 128.1 |
| 9a (C) | 141.6 |
| 10a (C) | 142.8 |
| 1' (CH) | 89.8 |
| 2' (CH) | 79.4 |
| 3' (CH) | 71.6 |
| 4' (CH) | 80.9 |
| 5' (CH2) | 60.9 |
| 7a (CH3) | 20.4 |
| 8a (CH3) | 20.6 |
