Spektraris NMR
Kipukasin E
Common Name: Kipukasin E
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H22N2O9/c1-9-6-10(27-2)7-11(28-3)14(9)18(25)30-16-15(24)12(8-22)29-17(16)21-5-4-13(23)20-19(21)26/h4-7,12,15-17,22,24H,8H2,1-3H3,(H,20,23,26)/t12-,15-,16-,17-/m1/s1
InChIKey: InChIKey=DOVSRUBRIYLZCI-BASLNEPJSA-N
Formula: C19H21N2O9
Molecular Weight: 421.378868
Exact Mass: 421.124705
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Jiao, P., Mudur, S.V., Gloer, J.B., Wicklow, D.T. J Nat Prod (2007) 70, 1308-11
Species:
Notes: Family : Nucleosides, Type : Uridines; 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) | 150 |
| 4 (C) | 162.5 |
| 5 (CH) | 103.1 |
| 6 (CH) | 141.5 |
| 1' (CH) | 89.9 |
| 2' (CH) | 75.5 |
| 3' (CH) | 70.1 |
| 4' (CH) | 85.3 |
| 5' (CH2) | 62.2 |
| 1'' (C) | 114 |
| 2'' (C) | 168.8 |
| 3'' (CH) | 96.7 |
| 4'' (C) | 162.5 |
| 5'' (CH) | 107.7 |
| 6'' (C) | 140.9 |
| 7'' (C) | 166.4 |
| 2''a (CH3) | 56.4 |
| 4''a (CH3) | 55.7 |
| 6''a (CH3) | 20.6 |
