D-Glucosamine 6-phosphate (C6H14NO8P)

D-Glucosamine 6-phosphate bmse000189 - Data bmst000178 - Theory

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BMRB entry bmse000189

Entry DOI: doi:10.13018/BMSE000189
Data source: Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Gareth Westler, Mark E. Anderson, John L. Markley

NMR-STAR file:

bmse000189.str

NMR-STAR

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Structure file (mol/sdf):

bmse000189.mol

All files for

bmse000189

Time Domain Data:

bmse000189.zip

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 - 400MHz

Atom ID	Author Nomenclature	Value	Ambiguity Code
C6	C1	96.285	6
C3	C2	59.752	6
C5	C3	71.968	6
C4	C4	74.837	6
C2	C5	78.382	6
C1	C6	65.413	6
H23	H17	5.458	6
H20	H18	3.291	6
H22	H19	3.879	6
H21	H20	3.656	6
H19	H21	3.937	6
H17	H22	4.008	6
H18	H23	4.001	6

NMR experiments

1: 1D 1H
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz

Download time domain data: bmse000189_1.zip

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

Download time domain data: bmse000189_2.zip

3: 1D 13C
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz

Download time domain data: bmse000189_3.zip

4: 1D DEPT90
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz

Download time domain data: bmse000189_4.zip

5: 1D DEPT135
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz

Download time domain data: bmse000189_5.zip

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

Download time domain data: bmse000189_6.zip