| Entry |
|
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| Name |
KDO2-lipid A;
Di[3-deoxy-D-manno-octulosonyl]-lipid A;
alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid A;
Dodecanoyl-(tetradecanoyl)-KDO2-lipid IV(A)
|
|---|
| Formula |
C110H202N2O39P2
|
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| Exact mass |
2237.336
|
|---|
| Mol weight |
2238.7184
|
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| Structure |
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|---|
| Reaction |
|
|---|
| Pathway |
| map00540 | Lipopolysaccharide biosynthesis |
| map01503 | Cationic antimicrobial peptide (CAMP) resistance |
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| Module |
| M00060 | KDO2-lipid A biosynthesis, Raetz pathway, LpxL-LpxM type |
|
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| Enzyme |
|
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| Brite |
Lipids [BR:br08002]
SL Saccharolipids
SL02 Acylaminosugar glycans
C06026 KDO2-lipid A
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| Other DBs |
|
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| KCF data |
ATOM 153
1 C1y C 18.6825 -13.5806
2 C1y C 19.8958 -12.8788
3 C1y C 17.4696 -12.8788
4 O7a O 18.6825 -14.9742
5 C1y C 19.8958 -11.4852
6 N1b N 21.0989 -13.5806
7 C1y C 17.4696 -11.4852
8 O2b O 16.2563 -13.5806
9 C7a C 17.4794 -15.6761
10 O2x O 18.6825 -10.7834
11 O2a O 21.0989 -10.7834
12 C5a C 21.0989 -14.9742
13 C1b C 16.2563 -10.7834
14 P1b P 14.8529 -13.5705
15 C1b C 17.4794 -17.0695
16 O6a O 16.2563 -14.9844
17 C1b C 22.3021 -10.0816
18 C1b C 22.3021 -15.6761
19 O5a O 19.8958 -15.6761
20 O2a O 16.2464 -9.3800
21 O1c O 14.8428 -12.1769
22 O1c O 13.4594 -13.5705
23 O1c O 14.8428 -14.9742
24 C1c C 16.2665 -17.7813
25 C1y C 23.5252 -10.7834
26 C1c C 22.3119 -17.0795
27 C1z C 16.2365 -7.9763
28 O7a O 15.0536 -17.0795
29 C1b C 16.2665 -19.1748
30 C1y C 23.5252 -12.1871
31 O2x O 24.7280 -10.0816
32 O7a O 23.5252 -17.7813
33 C1b C 21.0989 -17.7714
34 C1x C 15.0334 -8.6781
35 O2x O 16.2365 -6.5827
36 C6a C 17.5097 -8.4877
37 C7a C 13.8403 -17.7813
38 C1b C 15.0536 -19.8668
39 C1y C 24.7280 -12.8788
40 O1a O 22.3021 -12.5298
41 C1y C 25.9413 -10.7834
42 C7a C 23.5351 -19.1748
43 C1b C 21.0989 -19.1748
44 C1y C 13.8103 -7.9763
45 C1y C 15.0334 -5.8808
46 O6a O 17.5001 -9.8611
47 O6a O 18.6727 -7.7457
48 C1b C 13.8403 -19.1748
49 O6a O 12.6273 -17.0795
50 C1b C 15.0536 -21.2703
51 C1y C 25.9413 -12.1871
52 O7a O 24.7280 -14.2825
53 O2b O 27.1444 -10.0816
54 C1b C 22.3221 -19.8767
55 O6a O 24.7481 -19.8668
56 C1b C 19.8958 -19.8668
57 O2a O 12.7276 -8.7281
58 C1y C 13.8103 -6.5827
59 C1c C 14.9131 -4.4574
60 C1b C 12.6273 -19.8767
61 C1b C 13.8403 -21.9721
62 N1b N 27.9820 -12.8788
63 C7a C 25.9512 -14.9742
64 P1b P 27.1543 -8.6880
65 C1b C 22.3221 -21.2703
66 C1b C 19.8958 -21.2703
67 C1z C 11.5544 -9.4401
68 O1a O 12.5769 -5.9512
69 C1b C 16.0659 -3.6954
70 O1a O 13.6797 -3.8256
71 C1b C 12.6273 -21.2703
72 C1b C 13.8403 -23.3758
73 C5a C 29.2052 -12.1871
74 C1b C 25.9512 -16.3779
75 O6a O 27.1543 -14.2723
76 O1c O 25.7509 -8.6781
77 O1c O 27.1444 -7.2846
78 O1c O 28.5478 -8.6880
79 C1b C 21.1190 -21.9823
80 C1b C 18.6825 -21.9721
81 O2x O 10.3414 -8.7784
82 C1x C 11.5846 -10.8235
83 C6a C 12.7476 -10.1217
84 O1a O 16.0656 -2.3219
85 C1b C 11.4242 -21.9721
86 C1b C 12.6372 -24.0674
87 C1b C 30.4181 -12.8788
88 O5a O 29.2052 -10.7834
89 C1c C 27.1543 -17.0695
90 C1b C 21.1289 -23.3758
91 C1b C 18.6825 -23.3656
92 C1y C 9.1482 -9.5001
93 C1y C 10.4016 -11.5454
94 O6a O 13.9304 -9.4201
95 O6a O 12.7575 -11.4952
96 C1b C 11.4340 -23.3758
97 C1b C 12.6273 -25.4610
98 C1c C 30.4181 -14.2723
99 C1b C 27.1543 -18.4733
100 O1a O 28.3775 -16.3779
101 C1b C 19.9159 -24.0773
102 C1b C 17.4794 -24.0674
103 C1y C 9.1186 -10.8836
104 C1c C 7.9352 -8.8284
105 O1a O 10.4417 -12.9291
106 C1b C 10.2211 -24.0674
107 C1b C 11.4242 -26.1629
108 C1b C 31.6212 -14.9742
109 O1a O 29.2052 -14.9742
110 C1b C 28.3775 -19.1650
111 C1b C 19.9159 -25.4712
112 C1b C 17.4794 -25.4712
113 O1a O 7.9954 -11.6057
114 C1b C 7.9050 -7.4550
115 O1a O 6.7522 -9.5602
116 C1b C 10.2211 -25.4712
117 C1b C 11.4242 -27.5663
118 C1b C 31.6212 -16.3980
119 C1b C 28.3775 -20.5684
120 C1b C 18.7129 -26.1727
121 C1b C 16.2665 -26.1727
122 O1a O 6.6920 -6.8034
123 C1b C 9.0078 -26.1727
124 C1b C 10.2109 -28.2583
125 C1b C 32.8444 -17.1097
126 C1b C 29.5806 -21.2703
127 C1b C 18.7129 -27.5765
128 C1b C 16.2764 -27.5663
129 C1b C 9.0078 -27.5663
130 C1a C 10.2109 -29.6518
131 C1b C 32.8341 -18.5233
132 C1b C 29.5907 -22.6638
133 C1b C 17.4996 -28.2682
134 C1a C 15.0634 -28.2682
135 C1b C 7.8050 -28.2682
136 C1b C 34.0676 -19.2350
137 C1b C 30.8037 -23.3557
138 C1b C 17.4996 -29.6718
139 C1b C 7.8050 -29.6616
140 C1b C 34.0573 -20.6388
141 C1b C 30.7938 -24.7591
142 C1a C 16.2965 -30.3737
143 C1b C 6.5917 -30.3737
144 C1b C 35.2706 -21.3405
145 C1b C 31.9966 -25.4511
146 C1a C 6.5917 -31.7672
147 C1b C 35.2604 -22.7341
148 C1b C 31.9966 -26.8546
149 C1b C 36.4737 -23.4458
150 C1b C 33.2098 -27.5564
151 C1b C 36.4635 -24.8394
152 C1a C 33.2098 -28.9499
153 C1a C 37.6768 -25.5413
BOND 156
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 1 #Down
6 3 7 1
7 3 8 1 #Down
8 4 9 1
9 5 10 1
10 5 11 1 #Up
11 6 12 1
12 7 13 1 #Up
13 8 14 1
14 9 15 1
15 9 16 2
16 11 17 1
17 12 18 1
18 12 19 2
19 13 20 1
20 14 21 1
21 14 22 1
22 14 23 2
23 15 24 1
24 25 17 1 #Up
25 18 26 1
26 20 27 1
27 24 28 1 #Up
28 24 29 1
29 25 30 1
30 25 31 1
31 26 32 1 #Down
32 26 33 1
33 27 34 1
34 27 35 1
35 27 36 1 #Up
36 28 37 1
37 29 38 1
38 30 39 1
39 30 40 1 #Down
40 31 41 1
41 32 42 1
42 33 43 1
43 34 44 1
44 35 45 1
45 36 46 1
46 36 47 2
47 37 48 1
48 37 49 2
49 38 50 1
50 39 51 1
51 39 52 1 #Up
52 41 53 1 #Down
53 42 54 1
54 42 55 2
55 43 56 1
56 44 57 1 #Up
57 44 58 1
58 45 59 1 #Up
59 48 60 1
60 50 61 1
61 51 62 1 #Down
62 52 63 1
63 53 64 1
64 54 65 1
65 56 66 1
66 67 57 1 #Down
67 58 68 1 #Up
68 59 69 1
69 59 70 1 #Down
70 60 71 1
71 61 72 1
72 62 73 1
73 63 74 1
74 63 75 2
75 64 76 1
76 64 77 1
77 64 78 2
78 65 79 1
79 66 80 1
80 67 81 1
81 67 82 1
82 67 83 1 #Up
83 69 84 1
84 71 85 1
85 72 86 1
86 73 87 1
87 73 88 2
88 74 89 1
89 79 90 1
90 80 91 1
91 81 92 1
92 82 93 1
93 83 94 1
94 83 95 2
95 85 96 1
96 86 97 1
97 87 98 1
98 89 99 1
99 89 100 1 #Down
100 90 101 1
101 91 102 1
102 92 103 1
103 92 104 1 #Up
104 93 105 1 #Up
105 96 106 1
106 97 107 1
107 98 108 1
108 98 109 1 #Up
109 99 110 1
110 101 111 1
111 102 112 1
112 103 113 1 #Up
113 104 114 1
114 104 115 1 #Down
115 106 116 1
116 107 117 1
117 108 118 1
118 110 119 1
119 111 120 1
120 112 121 1
121 114 122 1
122 116 123 1
123 117 124 1
124 118 125 1
125 119 126 1
126 120 127 1
127 121 128 1
128 123 129 1
129 124 130 1
130 125 131 1
131 126 132 1
132 127 133 1
133 128 134 1
134 129 135 1
135 131 136 1
136 132 137 1
137 133 138 1
138 135 139 1
139 136 140 1
140 137 141 1
141 138 142 1
142 139 143 1
143 140 144 1
144 141 145 1
145 143 146 1
146 144 147 1
147 145 148 1
148 147 149 1
149 148 150 1
150 149 151 1
151 150 152 1
152 151 153 1
153 7 10 1
154 41 51 1
155 45 58 1
156 93 103 1
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|---|
