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Acknowledgement
Show PDB Carb
α-D-Neup
PDB CCD Name: Neuraminic acid
PDB CCD ID:
KDM
MoPCI carbohydrate ID: ohco2__o_O_gol
InChI: 1S/C9H14O9/c10-2-4(12)6(14)7-5(13)3(11)1-9(17,18-7)8(15)16/h3-7,10-14H,1-2H2/t3-,4+,5+,6+,7+,9+/m0/s1
InChIKey: CFYGBDBLKSCRIV-LSRLBZCKSA-N
Cremer-Pople puckering
Chair
Boat
Skew
Half-chair
Envelop
4C1
0
14B
0
1S3
0
1H2
0
1E
0
1C4
4
B14
4
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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