Entry |
|
Name |
Chondroitin 6-sulfate;
Chondroitin sulfate C;
Chondroitin 6'-sulfate
|
Formula |
(C14H21NO14S)n
|
Structure |
|
Reaction |
|
Network |
nt06029 Glycosaminoglycan biosynthesis |
Enzyme |
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 32
1 C1y C 28.5757 -20.5101
2 C1y C 29.7762 -19.8166
3 C1y C 29.7759 -18.4166
4 O2x O 28.5633 -17.7169
5 C1y C 27.3628 -18.4104
6 C1y C 27.3631 -19.8104
7 C1y C 24.2900 -22.9600
8 C1x C 24.2900 -24.3600
9 C1y C 25.5024 -25.0600
10 C1y C 26.7149 -24.3600
11 C1y C 26.7149 -22.9600
12 O2x O 25.5024 -22.2600
13 Z * 19.4376 -25.5500
14 O1a O 27.9460 -25.0710
15 O1a O 25.5024 -26.4598
16 C6a C 23.0776 -22.2600
17 O2a O 28.5760 -22.3190
18 O1a O 30.9714 -17.7257
19 C1b C 26.1554 -17.7137
20 O1a O 26.1562 -20.5076
21 N1b N 30.9662 -20.5034
22 O6a O 21.8821 -22.9504
23 O6a O 23.0775 -20.8602
24 C5a C 30.9666 -21.9097
25 C1a C 32.1592 -22.5981
26 Z * 34.8837 -20.0177
27 O5a O 29.7344 -22.6217
28 O2a O 24.6854 -17.7837
29 S4a S 23.2854 -17.7837
30 O1d O 23.2854 -19.1837
31 O1d O 23.2854 -16.3837
32 O1d O 21.8854 -17.7837
BOND 33
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 7 12 1
13 8 13 1 #Down
14 10 14 1 #Down
15 9 15 1 #Up
16 7 16 1 #Up
17 11 17 1 #Up
18 1 17 1 #Up
19 3 18 1 #Up
20 5 19 1 #Up
21 6 20 1 #Up
22 2 21 1 #Down
23 16 22 1
24 16 23 2
25 21 24 1
26 24 25 1
27 18 26 1
28 24 27 2
29 19 28 1
30 28 29 1
31 29 30 2
32 29 31 2
33 29 32 1
BRACKET 1 20.9300 -25.9700 20.9300 -22.1900
1 33.5300 -17.7800 33.5300 -21.5600
1 n
ORIGINAL 1 1 2 3 4 5 6 7 8 9 10 11 12 14 15 16 17
1 18 19 20 21 22 23 24 25 27 28 29 30 31 32
REPEAT 1
|