Glycogen (C24H42O21)
BMRB entry bmse000232
Entry DOI: doi:10.13018/BMSE000232
Data source: Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Mark E. Anderson, John L. Markley
NMR-STAR file:
bmse000232.strNMR-STAR
interactive viewerStructure file (mol/sdf):
bmse000232.molAll files for
bmse000232Time Domain Data:
bmse000232.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 |
|---|---|---|---|
| C20 | C1 | 102.510 | 4 |
| C20 | C1 | 79.551 | 4 |
| C20 | C1 | 75.583 | 4 |
| C20 | C1 | 74.206 | 4 |
| C20 | C1 | 72.045 | 4 |
| C8 | C2 | 102.510 | 4 |
| C8 | C2 | 79.551 | 4 |
| C8 | C2 | 75.583 | 4 |
| C8 | C2 | 74.206 | 4 |
| C8 | C2 | 72.045 | 4 |
| C14 | C4 | 102.510 | 4 |
| C14 | C4 | 79.551 | 4 |
| C14 | C4 | 75.583 | 4 |
| C14 | C4 | 74.206 | 4 |
| C14 | C4 | 72.045 | 4 |
| C23 | C7 | 102.510 | 4 |
| C23 | C7 | 79.551 | 4 |
| C23 | C7 | 75.583 | 4 |
| C23 | C7 | 74.206 | 4 |
| C23 | C7 | 72.045 | 4 |
| C18 | C8 | 102.510 | 4 |
| C18 | C8 | 79.551 | 4 |
| C18 | C8 | 75.583 | 4 |
| C18 | C8 | 74.206 | 4 |
| C18 | C8 | 72.045 | 4 |
| C24 | C10 | 102.510 | 4 |
| C24 | C10 | 79.551 | 4 |
| C24 | C10 | 75.583 | 4 |
| C24 | C10 | 74.206 | 4 |
| C24 | C10 | 72.045 | 4 |
| C17 | C13 | 102.510 | 4 |
| C17 | C13 | 79.551 | 4 |
| C17 | C13 | 75.583 | 4 |
| C17 | C13 | 74.206 | 4 |
| C17 | C13 | 72.045 | 4 |
| C22 | C16 | 102.510 | 4 |
| C22 | C16 | 79.551 | 4 |
| C22 | C16 | 75.583 | 4 |
| C22 | C16 | 74.206 | 4 |
| C22 | C16 | 72.045 | 4 |
| C6 | C17 | 102.510 | 4 |
| C6 | C17 | 79.551 | 4 |
| C6 | C17 | 75.583 | 4 |
| C6 | C17 | 74.206 | 4 |
| C6 | C17 | 72.045 | 4 |
| C12 | C18 | 102.510 | 4 |
| C12 | C18 | 79.551 | 4 |
| C12 | C18 | 75.583 | 4 |
| C12 | C18 | 74.206 | 4 |
| C12 | C18 | 72.045 | 4 |
| C19 | C20 | 102.510 | 4 |
| C19 | C20 | 79.551 | 4 |
| C19 | C20 | 75.583 | 4 |
| C19 | C20 | 74.206 | 4 |
| C19 | C20 | 72.045 | 4 |
| C16 | C22 | 102.510 | 4 |
| C16 | C22 | 79.551 | 4 |
| C16 | C22 | 75.583 | 4 |
| C16 | C22 | 74.206 | 4 |
| C16 | C22 | 72.045 | 4 |
| C10 | C23 | 102.510 | 4 |
| C10 | C23 | 79.551 | 4 |
| C10 | C23 | 75.583 | 4 |
| C10 | C23 | 74.206 | 4 |
| C10 | C23 | 72.045 | 4 |
| C7 | C26 | 102.510 | 4 |
| C7 | C26 | 79.551 | 4 |
| C7 | C26 | 75.583 | 4 |
| C7 | C26 | 74.206 | 4 |
| C7 | C26 | 72.045 | 4 |
| C13 | C27 | 102.510 | 4 |
| C13 | C27 | 79.551 | 4 |
| C13 | C27 | 75.583 | 4 |
| C13 | C27 | 74.206 | 4 |
| C13 | C27 | 72.045 | 4 |
| C5 | C28 | 102.510 | 4 |
| C5 | C28 | 79.551 | 4 |
| C5 | C28 | 75.583 | 4 |
| C5 | C28 | 74.206 | 4 |
| C5 | C28 | 72.045 | 4 |
| C11 | C29 | 102.510 | 4 |
| C11 | C29 | 79.551 | 4 |
| C11 | C29 | 75.583 | 4 |
| C11 | C29 | 74.206 | 4 |
| C11 | C29 | 72.045 | 4 |
| C15 | C35 | 102.510 | 4 |
| C15 | C35 | 79.551 | 4 |
| C15 | C35 | 75.583 | 4 |
| C15 | C35 | 74.206 | 4 |
| C15 | C35 | 72.045 | 4 |
| C9 | C37 | 102.510 | 4 |
| C9 | C37 | 79.551 | 4 |
| C9 | C37 | 75.583 | 4 |
| C9 | C37 | 74.206 | 4 |
| C9 | C37 | 72.045 | 4 |
| C21 | C40 | 102.510 | 4 |
| C21 | C40 | 79.551 | 4 |
| C21 | C40 | 75.583 | 4 |
| C21 | C40 | 74.206 | 4 |
| C21 | C40 | 72.045 | 4 |
| H69 | H46 | 5.387 | 4 |
| H57 | H47 | 5.387 | 4 |
| H63 | H48 | 5.387 | 4 |
| H52 | H49 | 3.832 | 4 |
| H53 | H50 | 3.832 | 4 |
| H72 | H51 | 5.387 | 4 |
| H67 | H52 | 5.387 | 4 |
| H73 | H54 | 5.387 | 4 |
| H66 | H55 | 5.387 | 4 |
| H71 | H57 | 5.387 | 4 |
| H55 | H58 | 5.387 | 4 |
| H61 | H59 | 5.387 | 4 |
| H85 | H60 | 5.387 | 4 |
| H68 | H61 | 5.387 | 4 |
| H65 | H62 | 5.387 | 4 |
| H59 | H63 | 5.387 | 4 |
| H48 | H64 | 3.832 | 4 |
| H49 | H65 | 3.832 | 4 |
| H56 | H67 | 5.387 | 4 |
| H62 | H68 | 5.387 | 4 |
| H54 | H69 | 5.387 | 4 |
| H60 | H70 | 5.387 | 4 |
| H50 | H74 | 3.832 | 4 |
| H51 | H75 | 3.832 | 4 |
| H64 | H76 | 5.387 | 4 |
| H58 | H78 | 3.832 | 4 |
| H46 | H79 | 3.832 | 4 |
| H47 | H80 | 3.832 | 4 |
| H70 | H82 | 3.832 | 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
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
