UDP (C9H14N2O12P2)
BMRB entry bmse000266
Entry DOI: doi:10.13018/BMSE000266
Data source: Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Mark E. Anderson, John L. Markley
NMR-STAR file:
bmse000266.strNMR-STAR
interactive viewerStructure file (mol/sdf):
bmse000266.molAll files for
bmse000266Time Domain Data:
bmse000266.zipSample 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 - 400MHz
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C3 | C17 | 66.832 | 1 |
| C3 | C17 | 66.779 | 1 |
| C8 | C18 | 91.445 | 1 |
| C4 | C19 | 85.902 | 1 |
| C4 | C19 | 85.814 | 1 |
| C7 | C20 | 76.596 | 1 |
| C6 | C21 | 71.826 | 1 |
| C9 | C22 | 154.545 | 1 |
| C5 | C23 | 169.089 | 1 |
| C2 | C24 | 144.524 | 1 |
| C1 | C25 | 105.234 | 1 |
| H28 | H32 | 4.242 | 4 |
| H29 | H33 | 4.242 | 4 |
| H33 | H34 | 5.958 | 4 |
| H30 | H35 | 4.242 | 4 |
| H32 | H36 | 4.407 | 4 |
| H31 | H37 | 4.407 | 4 |
| H27 | H38 | 7.990 | 1 |
| H26 | H39 | 5.958 | 4 |
NMR experiments
1: 1D 1H
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
2: 2D [1H,1H]-TOCSY
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
![Spectrum for experiment #2: 2D [1H,1H]-TOCSY](/ftp/pub/bmrb/metabolomics/entry_directories/bmse000266/nmr/set01/spectra/HH_TOCSY.png)
3: 1D 13C
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
4: 1D DEPT90
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
5: 1D DEPT135
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
6: 2D [1H,13C]-HSQC
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
![Spectrum for experiment #6: 2D [1H,13C]-HSQC](/ftp/pub/bmrb/metabolomics/entry_directories/bmse000266/nmr/set01/spectra/1H_13C_HSQC.png)