COMPOUND: C04099
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Entry
C04099 Compound
Name
1,4-alpha-D-Glucooligosaccharide;
1,4-alpha-D-Glucooligosaccharide in lipopolysaccharide precursor
Formula
(C18H30O15)n
Structure
Mol file
KCF file
DB search
Reaction
R04396
Enzyme
2.1.1.18
Other DBs
PubChem:
6790
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KCF data
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ATOM 35
1 C1y C 22.5400 -11.9000
2 C1y C 22.5400 -13.3000
3 C1y C 23.7300 -14.0000
4 C1y C 24.9900 -13.3000
5 C1y C 24.9900 -11.9000
6 O2x O 23.7300 -11.2000
7 O1a O 26.1800 -11.2000
8 O1a O 26.1800 -14.0000
9 O2a O 21.3500 -14.0000
10 C1b C 21.3500 -11.2000
11 O1a O 23.7300 -15.4000
12 O1a O 21.3500 -9.8000
13 C1y C 17.7100 -14.7000
14 C1y C 17.7100 -16.1000
15 C1y C 18.9000 -16.8000
16 C1y C 20.1600 -16.1000
17 C1y C 20.1600 -14.7000
18 O2x O 18.9000 -14.0000
19 O1a O 21.3500 -16.8000
20 O2a O 16.5200 -16.8000
21 C1b C 16.5200 -14.0000
22 O1a O 18.9000 -18.2000
23 O1a O 16.5200 -12.6000
24 C1y C 12.8800 -17.5000
25 C1x C 12.8800 -18.9000
26 C1y C 14.0700 -19.6000
27 C1y C 15.3300 -18.9000
28 C1y C 15.3300 -17.5000
29 O2x O 14.0700 -16.8000
30 O1a O 16.5200 -19.6000
31 Z * 8.7500 -19.8800
32 C1b C 11.6900 -16.8000
33 O1a O 14.0700 -21.0000
34 O1a O 11.6900 -15.4000
35 Z * 29.8200 -11.6200
BOND 37
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 5 7 1 #Down
8 4 8 1 #Down
9 2 9 1 #Down
10 1 10 1 #Up
11 3 11 1 #Up
12 10 12 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 13 18 1
19 17 9 1 #Down
20 16 19 1 #Down
21 14 20 1 #Down
22 13 21 1 #Up
23 15 22 1 #Up
24 21 23 1
25 24 25 1
26 25 26 1
27 26 27 1
28 27 28 1
29 28 29 1
30 24 29 1
31 28 20 1 #Down
32 27 30 1 #Down
33 25 31 1 #Down
34 24 32 1 #Up
35 26 33 1 #Up
36 32 34 1
37 7 35 1
BRACKET 1 10.9200 -21.7000 10.9200 -10.2200
1 28.0000 -10.2200 28.0000 -21.7000
1 n
ORIGINAL 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16
1 17 18 19 20 21 22 23 24 25 26 27 28 29 30 32 33
1 34
REPEAT 1
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