D-Fructose 2,6-bisphosphate (C6H14O12P2)
BMRB entry bmse000275
Entry DOI: doi:10.13018/BMSE000275
Data source: Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Gareth Westler, Mark E. Anderson, John L. Markley
NMR-STAR file:
bmse000275.strNMR-STAR
interactive viewerStructure file (mol/sdf):
bmse000275.molAll files for
bmse000275Time Domain Data:
bmse000275.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 |
|---|---|---|---|
| C2 | C15 | 65.199 | 1 |
| C1 | C16 | 68.331 | 1 |
| C6 | C17 | 106.835 | 1 |
| C3 | C18 | 78.054 | 1 |
| C5 | C19 | 82.949 | 1 |
| C4 | C20 | 80.026 | 1 |
| H23 | H28 | 3.89 | 1 |
| H24 | H29 | 3.89 | 1 |
| H21 | H30 | 3.971 | 1 |
| H22 | H31 | 3.971 | 1 |
| H25 | H32 | 4.181 | 1 |
| H27 | H33 | 3.938 | 1 |
| H26 | H34 | 4.048 | 1 |
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/bmse000275/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/bmse000275/nmr/set01/spectra/1H_13C_HSQC.png)