| Entry |
|
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| Name |
(7Z,10Z,13Z,16Z)-Docosatetraenoyl-CoA
|
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| Formula |
C43H70N7O17P3S
|
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| Exact mass |
1081.3762
|
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| Mol weight |
1082.04
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| Structure |
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| Reaction |
|
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| Pathway |
| map01040 | Biosynthesis of unsaturated fatty acids |
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| Enzyme |
3.1.2.-
|
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| Brite |
Lipids [BR:br08002]
FA Fatty acyls
FA07 Fatty esters
FA0705 Fatty acyl CoAs
C16170 (7Z,10Z,13Z,16Z)-Docosatetraenoyl-CoA
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| Other DBs |
|
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| LinkDB |
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| KCF data |
ATOM 71
1 S2a S 29.6800 -24.7100
2 C1b C 30.8700 -24.0100
3 C1b C 32.1300 -24.7100
4 N1b N 33.3200 -24.0100
5 C5a C 34.5100 -24.7100
6 C1b C 35.7700 -24.0100
7 C1b C 36.9600 -24.7100
8 N1b N 38.1500 -24.0100
9 C5a C 39.4100 -24.7100
10 C1c C 40.6000 -24.0100
11 C1d C 41.7900 -24.7100
12 C1b C 42.9800 -24.0100
13 O2b O 44.2400 -24.7100
14 O5a O 34.5100 -26.1100
15 O5a O 39.4100 -26.1100
16 O1a O 40.6000 -22.6100
17 C1a C 41.7900 -23.3100
18 C1a C 41.7900 -26.1100
19 P1b P 45.6400 -24.7100
20 O1c O 47.0400 -24.7100
21 O1c O 45.6400 -26.1100
22 C1y C 39.1300 -19.7400
23 C1y C 40.5300 -19.7400
24 C1y C 40.9500 -18.4100
25 O2x O 39.8300 -17.5700
26 C1y C 38.7100 -18.4100
27 C1b C 42.2800 -17.9900
28 O1a O 38.2900 -20.8600
29 O2b O 41.3700 -20.8600
30 P1b P 42.7700 -20.8600
31 O1c O 42.7700 -19.4600
32 O1c O 44.1700 -20.8600
33 O1c O 42.7700 -22.2600
34 C8y C 34.5800 -16.5900
35 C8y C 34.5800 -17.9900
36 N4y N 37.0300 -17.9900
37 C8x C 37.0300 -16.5900
38 N5x N 35.7700 -15.8900
39 C8y C 33.3900 -15.8900
40 N5x N 32.1300 -16.5900
41 C8x C 32.1300 -17.9900
42 N5x N 33.3900 -18.6900
43 N1a N 33.3900 -14.4900
44 O2b O 44.2400 -18.4100
45 P1b P 45.6400 -18.4100
46 O1c O 45.6400 -17.0100
47 O1c O 47.0400 -18.4100
48 O2c O 45.6400 -21.6300
49 C5a C 28.5600 -24.0100
50 O5a O 28.5600 -22.6800
51 C1b C 27.3700 -24.7100
52 C1b C 26.1800 -24.0100
53 C1b C 24.9200 -24.7100
54 C1b C 23.7300 -24.0100
55 C1b C 22.5400 -24.7100
56 C2b C 21.3500 -24.0100
57 C2b C 19.9500 -24.0100
58 C1b C 18.7600 -24.7100
59 C2b C 17.5000 -24.0100
60 C2b C 16.1000 -24.0100
61 C1b C 14.9100 -24.7100
62 C2b C 13.7200 -24.0100
63 C2b C 12.3900 -24.0100
64 C1b C 11.1300 -24.7100
65 C2b C 9.9400 -24.0100
66 C2b C 8.6100 -24.0100
67 C1b C 7.3500 -24.7100
68 C1b C 6.1600 -24.0100
69 C1b C 4.9000 -24.7100
70 C1b C 3.7100 -24.0100
71 C1a C 2.4500 -24.7100
BOND 73
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 5 14 2
14 9 15 2
15 10 16 1 #Down
16 11 17 1
17 11 18 1
18 13 19 1
19 19 20 2
20 19 21 1
21 22 23 1
22 23 24 1
23 24 25 1
24 25 26 1
25 22 26 1
26 24 27 1 #Down
27 22 28 1 #Up
28 23 29 1 #Up
29 29 30 1
30 30 31 1
31 30 32 1
32 30 33 2
33 34 35 2
34 35 36 1
35 36 37 1
36 37 38 2
37 34 38 1
38 34 39 1
39 39 40 2
40 40 41 1
41 41 42 2
42 35 42 1
43 39 43 1
44 26 36 1 #Down
45 27 44 1
46 44 45 1
47 45 46 1
48 45 47 2
49 45 48 1
50 19 48 1
51 1 49 1
52 49 50 2
53 49 51 1
54 51 52 1
55 52 53 1
56 53 54 1
57 54 55 1
58 55 56 1
59 56 57 2
60 57 58 1
61 58 59 1
62 59 60 2
63 60 61 1
64 61 62 1
65 62 63 2
66 63 64 1
67 64 65 1
68 65 66 2
69 66 67 1
70 67 68 1
71 68 69 1
72 69 70 1
73 70 71 1
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|---|
