Complex Carbohydrate Magnetic Resonance Database (CCMRD)
A solid-state NMR database for complex carbohydrates developed at Michigan State University. Solid-state NMR spectroscopy reveals the molecular structure and 3D dynamics of insoluble complex carbohydrates and cell wall polymers.
669 Compound Entries
Solid-State NMR Shifts
SNFG Structure Notation
| Database ID | Trivial Name | Linear Code | Compound Class | Taxonomy Domain | Species | Residue | SNFG Diagram | Chemical Structure | Chemical Shifts (ppm) | Spectrometer (MHz) | Temp (K) | pH | Reference Compound | Sample Treatment | Reference & Publication |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| ccmrd_223 | Cellulose | Glcp | Polysaccharide | bacteria | Komagataeibacter xylinus | b-D-Glcp |
|
|
C1: 100.4, C2: 73.5, C3: 75.8, C4: 80.1, C5: 75.8, C6: 65.2 | 300 | 296.0 | - | ND | Biosynthesized and purified cellulose |
Hiroyuki Kono et al. (2002)
CP/MAS (13)C NMR study of cellulose and cellulose derivatives. 2. Complete assignment of the (13)C resonance for the ring carbons of cellulose triacetate polymorphs Journal of the American Chemical Society |
| ccmrd_224 | Cellulose | Glcp | Polysaccharide | bacteria | Komagataeibacter xylinus | b-D-Glcp |
|
|
C2: 76.6, C3: 74.8, C4: 78.7, C6: 67.3 | 300 | 296.0 | - | ND | Biosynthesized and purified cellulose |
Hiroyuki Kono et al. (2002)
CP/MAS (13)C NMR study of cellulose and cellulose derivatives. 2. Complete assignment of the (13)C resonance for the ring carbons of cellulose triacetate polymorphs Journal of the American Chemical Society |
| ccmrd_225 | Chitin | GlcpNAc | Polysaccharide | other | Commercial chemical compound | a-?-GlcpNAc |
|
|
C1: 104.0, C2: 54.8, C3: 73.4, C4: 82.9, C5: 75.6, C6: 60.6, C7: 173.0, C8: 22.6, H1: 4.6, H2: 3.3, H3: 3.1, H4: 3.0, H5: 3.0, H6: 3.1, H8: 1.1 | 300 | 298.0 | - | D-glycine | Purified chitin |
Hiroyuki Kono et al. (2004)
Two-dimensional magic angle spinning NMR investigation of naturally occurring chitins: precise 1H and 13C resonance assignment of alpha- and beta-chitin Biopolymers |
| ccmrd_226 | Chitin | GlcpNAc | Polysaccharide | other | Squid pen | b-?-GlcpNAc |
|
|
C1: 104.1, C2: 55.2, C3: 74.2, C4: 83.4, C5: 73.6, C6: 60.8, C7: 173.6, C8: 22.8, H1: 3.7, H2: 3.3, H3: 3.1, H4: 3.1, H5: 3.1, H6: 3.0, H8: 1.5 | 300 | 298.0 | - | D-glycine | Extracted and purified chitin |
Hiroyuki Kono et al. (2004)
Two-dimensional magic angle spinning NMR investigation of naturally occurring chitins: precise 1H and 13C resonance assignment of alpha- and beta-chitin Biopolymers |
| ccmrd_227 | Cellulose | Glcp | Polysaccharide | algae | Cladophora sp. | b-D-Glcp |
|
|
C1: 105.0, C2: 71.6, C3: 74.7, C4: 90.0, C5: 70.1, C6: 65.2, H1: 4.0, H3: 3.2, H4: 3.1, H6: 2.9 | 300 | 298.0 | - | D-glycine | Biosynthesized and purified cellulose |
Hiroyuki Kono et al. (2003)
Determination of the Through-Bond Carbon-Carbon and Carbon-Proton Connectivities of the Native Celluloses in the Solid State Macromolecules |
| ccmrd_228 | Cellulose | Glcp | Polysaccharide | algae | Cladophora sp. | b-D-Glcp |
|
|
C1: 105.0, C2: 70.1, C3: 73.9, C4: 89.1, C5: 72.6, C6: 65.2, H1: 4.0, H3: 3.5, H4: 3.4, H5: 3.4, H6: 2.9 | 300 | 298.0 | - | D-glycine | Biosynthesized and purified cellulose |
Hiroyuki Kono et al. (2003)
Determination of the Through-Bond Carbon-Carbon and Carbon-Proton Connectivities of the Native Celluloses in the Solid State Macromolecules |
| ccmrd_229 | Cellulose | Glcp | Polysaccharide | algae | Cladophora sp. | b-D-Glcp |
|
|
C1: 106.1, C2: 71.3, C3: 74.9, C4: 88.0, C5: 70.6, C6: 65.6, H1: 4.5, H3: 3.2, H4: 3.4, H6: 4.5 | 300 | 298.0 | - | D-glycine | Biosynthesized and purified cellulose |
Hiroyuki Kono et al. (2003)
Determination of the Through-Bond Carbon-Carbon and Carbon-Proton Connectivities of the Native Celluloses in the Solid State Macromolecules |
| ccmrd_230 | Cellulose | Glcp | Polysaccharide | algae | Cladophora sp. | b-D-Glcp |
|
|
C1: 104.0, C2: 71.0, C3: 74.2, C4: 88.9, C5: 72.2, C6: 65.0, H1: 4.9, H3: 3.8, H4: 3.1, H5: 3.7, H6: 3.9 | 300 | 298.0 | - | D-glycine | Biosynthesized and purified cellulose |
Hiroyuki Kono et al. (2003)
Determination of the Through-Bond Carbon-Carbon and Carbon-Proton Connectivities of the Native Celluloses in the Solid State Macromolecules |
| ccmrd_231 | Cellulose | Glcp | Polysaccharide | algae | Ventricaria ventricosa | b-D-Glcp |
|
|
C1: 107.0, C2: 73.4, C3: 79.4, C4: 86.4, C5: 78.3, C6: 63.8 | 300 | 298.0 | - | D-glycine | Purified cellulose |
Yukari Numata et al. (2003)
Cross-polarization/magic-angle spinning 13C nuclear magnetic resonance study of cellulose I-ethylenediamine complex Journal of bioscience and bioengineering |
| ccmrd_232 | Cellulose | Glcp | Polysaccharide | algae | Cladophora sp. | b-D-Glcp |
|
|
C1: 106.9, C2: 73.6, C3: 76.2, C4: 91.6, C5: 74.4, C6: 65.0 | 300 | 296.0 | - | D-glycine | Biosynthesized and purified cellulose |
Hiroyuki Kono et al. (2002)
CP/MAS (13)C NMR study of cellulose and cellulose derivatives. 1. Complete assignment of the CP/MAS (13)C NMR spectrum of the native cellulose Journal of the American Chemical Society |