2'-Deoxyuridine (C9H12N2O5)
BMRB entry bmse000320
Entry DOI: doi:10.13018/BMSE000320
Data source: Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Mark E. Anderson, John L. Markley
NMR-STAR file:
bmse000320.strNMR-STAR
interactive viewerStructure file (mol/sdf):
bmse000320.molAll files for
bmse000320Time Domain Data:
bmse000320.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 |
|---|---|---|---|
| C5 | C8 | 73.19 | 1 |
| C3 | C9 | 41.404 | 1 |
| C8 | C10 | 88.185 | 1 |
| C6 | C11 | 89.416 | 1 |
| C4 | C12 | 63.916 | 1 |
| C9 | C13 | 154.378 | 1 |
| C2 | C14 | 144.691 | 1 |
| C1 | C15 | 104.912 | 1 |
| C7 | C16 | 169.1 | 1 |
| H23 | H17 | 4.451 | 1 |
| H25 | H18 | 6.271 | 1 |
| H19 | H19 | 2.385 | 2 |
| H20 | H20 | 2.385 | 2 |
| H24 | H21 | 4.038 | 1 |
| H21 | H22 | 3.784 | 2 |
| H22 | H23 | 3.784 | 2 |
| H18 | H25 | 7.841 | 1 |
| H17 | H27 | 5.876 | 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/bmse000320/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/bmse000320/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/bmse000320/nmr/set01/spectra/1H_13C_HMBC.png)