BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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N-Acetyl-D-glucosamine 1-phosphate (C8H16NO9P)

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BMRB entry bmse000163

Entry DOI: doi:10.13018/BMSE000163
Data source: Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Mark E. Anderson, John L. Markley

NMR-STAR file: bmse000163.str
NMR-STAR interactive viewer
Mol file: bmse000163.mol
All files for bmse000163
Time Domain Data: bmse000163.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 IDAuthor NomenclatureValueAmbiguity Code
C5C156.9001
C5C156.8261
C8C295.4941
C8C295.4401
C7C374.8014
C7C374.1394
C7C372.7234
C6C774.8014
C6C774.1394
C6C772.7234
C3C9177.4251
C4C1074.8014
C4C1074.1394
C4C1072.7234
C1C1324.8581
C2C1563.4051
H26H203.9124
H26H203.7764
H26H203.4714
H29H215.3421
H28H223.9124
H28H223.7764
H28H223.4714
H27H243.9124
H27H243.7764
H27H243.4714
H25H263.9124
H25H263.7764
H25H263.4714
H20H282.0521
H22H292.0521
H21H302.0521
H23H313.9121
H23H313.7761
H24H323.9121
H24H323.7761

NMR experiments

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

 spectrum for 1
Download time domain data: bmse000163_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 2
Download time domain data: bmse000163_2.zip

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

 spectrum for 3
Download time domain data: bmse000163_3.zip

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

 spectrum for 4
Download time domain data: bmse000163_4.zip

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

 spectrum for 5
Download time domain data: bmse000163_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 6
Download time domain data: bmse000163_6.zip