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Show PDB Carb
β-D-GlcpA2,3dMe
PDB CCD Name: 2,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACID
PDB CCD ID:
GU1
MoPCI carbohydrate ID: O_oc_OC_o_CO2
InChI: 1S/C8H13O7/c1-13-4-3(9)5(7(10)11)15-8(12)6(4)14-2/h3-6,8-9,12H,1-2H3/t3-,4-,5-,6+,8+/m0/s1
InChIKey: UGVGDTFDNNZVEG-GRJZWZNASA-N
Cremer-Pople puckering
Chair
Boat
Skew
Half-chair
Envelop
4C1
6
14B
0
1S3
0
1H2
0
1E
0
1C4
0
B14
0
3S1
0
2H1
0
E1
0
25B
0
5S1
0
2H3
0
2E
0
B25
0
1S5
0
3H2
0
E2
0
36B
0
6S2
0
3H4
0
3E
0
B36
0
2S6
0
4H3
0
E3
0
4H5
0
4E
0
5H4
0
E4
0
5H6
0
5E
0
6H5
0
E5
0
6H1
0
6E
0
1H6
0
E6
0
Molecular modelling of Carbohydrate ring puckering
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