Entry |
|
Name |
|
Formula |
(C14H18NO11R3)n
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Structure |

|
Remark |
|
Comment |
Generic compound in reaction hierarchy
R = SO3- or H
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Reaction |
|
Pathway |
|
Module |
M00076 | Dermatan sulfate degradation |
|
Network |
nt06012 Glycosaminoglycan degradation |
Enzyme |
3.2.-.-
|
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
B BLOOD AND BLOOD FORMING ORGANS
B01 ANTITHROMBOTIC AGENTS
B01A ANTITHROMBOTIC AGENTS
B01AX Other antithrombotic agents
B01AX04 Dermatan sulfate
C00426 Dermatan sulfate
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Other DBs |
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LinkDB |
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KCF data |
ATOM 31
1 O1a O 14.5872 -20.1683
2 C1y C 16.4296 -19.1183
3 C1y C 17.6536 -19.8251
4 C1y C 18.8661 -19.1253
5 C1y C 18.8663 -17.7253
6 O2x O 17.6423 -17.0184
7 C1y C 16.4298 -17.7183
8 O1a O 17.6533 -21.2099
9 O2a O 20.1107 -17.0070
10 C1y C 20.1107 -15.6070
11 O2a O 20.0967 -19.8366
12 C1y C 21.3062 -14.9166
13 C1x C 21.3061 -13.5166
14 O2x O 20.0936 -12.8167
15 C1y C 18.8981 -13.5071
16 C1y C 18.8982 -14.9071
17 O2a O 17.6859 -15.6071
18 Z * 23.4816 -11.7060
19 N1b N 22.4961 -15.6036
20 C5a C 23.6824 -14.9100
21 C1a C 24.8949 -15.6100
22 O5a O 23.6786 -13.5101
23 C1b C 17.6883 -12.8088
24 O2a O 17.7583 -11.1987
25 R R 19.5148 -9.8824
26 R R 16.0029 -14.2182
27 R R 21.8058 -18.9237
28 Z * 12.3749 -19.6574
29 C6a C 15.2292 -17.0247
30 O6a O 14.0461 -17.7075
31 O6a O 15.2291 -15.6103
BOND 32
1 2 1 1 #Down
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 2 7 1
8 3 8 1 #Up
9 5 9 1 #Up
10 10 9 1 #Up
11 4 11 1 #Down
12 10 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 10 16 1
18 16 17 1 #Up
19 13 18 1 #Up
20 12 19 1 #Down
21 19 20 1
22 20 21 1
23 20 22 2
24 15 23 1 #Up
25 23 24 1
26 24 25 1
27 17 26 1
28 11 27 1
29 1 28 1
30 29 30 1
31 29 31 2
32 7 29 1 #Down
BRACKET 1 14.0000 -21.2100 14.0000 -18.7600
1 21.7000 -11.4800 21.7000 -13.9300
1 n
ORIGINAL 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16
1 17 19 20 21 22 23 24 25 26 27 29 30 31
REPEAT 1
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