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Acknowledgement
Show PDB Carb
β-D-Glcp1No
PDB CCD Name: b-NONYLGLUCOSIDE
PDB CCD ID:
BNG
MoPCI carbohydrate ID: OC9_o_O_o_CO
InChI: 1S/C15H30O6/c1-2-3-4-5-6-7-8-9-20-15-14(19)13(18)12(17)11(10-16)21-15/h11-19H,2-10H2,1H3/t11-,12-,13+,14-,15-/m1/s1
InChIKey: QFAPUKLCALRPLH-UXXRCYHCSA-N
Cremer-Pople puckering
Chair
Boat
Skew
Half-chair
Envelop
4C1
210
14B
4
1S3
0
1H2
0
1E
0
1C4
0
B14
0
3S1
2
2H1
2
E1
4
25B
0
5S1
0
2H3
0
2E
1
B25
0
1S5
0
3H2
0
E2
0
36B
0
6S2
2
3H4
0
3E
0
B36
0
2S6
6
4H3
3
E3
1
4H5
1
4E
1
5H4
0
E4
0
5H6
0
5E
0
6H5
0
E5
3
6H1
4
6E
0
1H6
0
E6
0
Molecular modelling of Carbohydrate ring puckering
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