5-methyluridine (C10H14N2O6)
BMRB entry bmse000759
Entry DOI: doi:10.13018/BMSE000759
Data source: Madison Metabolomics Consortium - Francisca Jofre, Mark E. Anderson, John L. Markley, Ravi Rapolu
NMR-STAR file:
bmse000759.strNMR-STAR
interactive viewerStructure file (mol/sdf):
bmse000759.molAll files for
bmse000759Time Domain Data:
bmse000759.zipView the GISSMO record for this entry.
Sample and instrument details are given with the spectrum
Assigned chemical shifts
Set 1
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C7 | C9 | 76.246 | 1 |
| C6 | C10 | 72.078 | 1 |
| C9 | C11 | 91.626 | 1 |
| C5 | C12 | 86.859 | 1 |
| C3 | C13 | 63.383 | 1 |
| C2 | C14 | 140.094 | 1 |
| C10 | C15 | 154.567 | 1 |
| C4 | C16 | 114.175 | 1 |
| C8 | C17 | 169.260 | 1 |
| C1 | C18 | 14.300 | 1 |
| H27 | H19 | 4.334 | 1 |
| H26 | H20 | 4.237 | 1 |
| H28 | H21 | 5.909 | 1 |
| H25 | H22 | 4.109 | 1 |
| H23 | H23 | 3.911 | 1 |
| H23 | H23 | 3.812 | 1 |
| H24 | H24 | 3.911 | 1 |
| H24 | H24 | 3.812 | 1 |
| H22 | H27 | 7.696 | 1 |
| H21 | H30 | 1.882 | 1 |
| H20 | H31 | 1.882 | 1 |
| H19 | H32 | 1.882 | 1 |
NMR experiments
1: 1D 1H
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
2: 2D [1H,1H]-TOCSY
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
![Spectrum for experiment #2: 2D [1H,1H]-TOCSY](/ftp/pub/bmrb/metabolomics/entry_directories/bmse000759/nmr/set01/spectra/HH_TOCSY.png)
3: 1D 13C
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
4: 1D DEPT90
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
5: 1D DEPT135
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
6: 2D [1H,13C]-HSQC
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
![Spectrum for experiment #6: 2D [1H,13C]-HSQC](/ftp/pub/bmrb/metabolomics/entry_directories/bmse000759/nmr/set01/spectra/1H_13C_HSQC.png)
7: 2D [1H,13C]-HMBC
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
![Spectrum for experiment #7: 2D [1H,13C]-HMBC](/ftp/pub/bmrb/metabolomics/entry_directories/bmse000759/nmr/set01/spectra/1H_13C_HMBC.png)
8: 2D [1H,1H]-COSY
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
![Spectrum for experiment #8: 2D [1H,1H]-COSY](/ftp/pub/bmrb/metabolomics/entry_directories/bmse000759/nmr/set01/spectra/HH_COSY.png)