| Entry |
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| Name |
(9Z,12Z,15Z,18Z)-Tetracosatetraenoyl-CoA
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| Formula |
C45H74N7O17P3S
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| Exact mass |
1109.4075
|
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| Mol weight |
1110.092
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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 |
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| Brite |
Lipids [BR:br08002]
FA Fatty acyls
FA07 Fatty esters
FA0705 Fatty acyl CoAs
C16171 (9Z,12Z,15Z,18Z)-Tetracosatetraenoyl-CoA
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 73
1 S2a S 32.0600 -23.9400
2 C1b C 33.2500 -23.2400
3 C1b C 34.5100 -23.9400
4 N1b N 35.7000 -23.2400
5 C5a C 36.8900 -23.9400
6 C1b C 38.1500 -23.2400
7 C1b C 39.3400 -23.9400
8 N1b N 40.5300 -23.2400
9 C5a C 41.7900 -23.9400
10 C1c C 42.9800 -23.2400
11 C1d C 44.1700 -23.9400
12 C1b C 45.3600 -23.2400
13 O2b O 46.6200 -23.9400
14 O5a O 36.8900 -25.3400
15 O5a O 41.7900 -25.3400
16 O1a O 42.9800 -21.8400
17 C1a C 44.1700 -22.5400
18 C1a C 44.1700 -25.3400
19 P1b P 48.0200 -23.9400
20 O1c O 49.4200 -23.9400
21 O1c O 48.0200 -25.3400
22 C1y C 41.5100 -18.9700
23 C1y C 42.9100 -18.9700
24 C1y C 43.3300 -17.6400
25 O2x O 42.2100 -16.8000
26 C1y C 41.0900 -17.6400
27 C1b C 44.6600 -17.2200
28 O1a O 40.6700 -20.0900
29 O2b O 43.7500 -20.0900
30 P1b P 45.1500 -20.0900
31 O1c O 45.1500 -18.6900
32 O1c O 46.5500 -20.0900
33 O1c O 45.1500 -21.4900
34 C8y C 36.9600 -15.8200
35 C8y C 36.9600 -17.2200
36 N4y N 39.4100 -17.2200
37 C8x C 39.4100 -15.8200
38 N5x N 38.1500 -15.1200
39 C8y C 35.7700 -15.1200
40 N5x N 34.5100 -15.8200
41 C8x C 34.5100 -17.2200
42 N5x N 35.7700 -17.9200
43 N1a N 35.7700 -13.7200
44 O2b O 46.6200 -17.6400
45 P1b P 48.0200 -17.6400
46 O1c O 48.0200 -16.2400
47 O1c O 49.4200 -17.6400
48 O2c O 48.0200 -20.8600
49 C5a C 30.9400 -23.2400
50 O5a O 30.9400 -21.9100
51 C1b C 29.7500 -23.9400
52 C1b C 28.5600 -23.2400
53 C1b C 27.3000 -23.9400
54 C1b C 26.1100 -23.2400
55 C1b C 24.9200 -23.9400
56 C1b C 23.7300 -23.2400
57 C1b C 22.5400 -23.9400
58 C2b C 21.3500 -23.2400
59 C2b C 19.9500 -23.2400
60 C1b C 18.7600 -23.9400
61 C2b C 17.5000 -23.2400
62 C2b C 16.1000 -23.2400
63 C1b C 14.9100 -23.9400
64 C2b C 13.7200 -23.2400
65 C2b C 12.3900 -23.2400
66 C1b C 11.1300 -23.9400
67 C2b C 9.9400 -23.2400
68 C2b C 8.6100 -23.2400
69 C1b C 7.3500 -23.9400
70 C1b C 6.1600 -23.2400
71 C1b C 4.9000 -23.9400
72 C1b C 3.7100 -23.2400
73 C1a C 2.4500 -23.9400
BOND 75
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 1
60 57 58 1
61 58 59 2
62 59 60 1
63 60 61 1
64 61 62 2
65 62 63 1
66 63 64 1
67 64 65 2
68 65 66 1
69 66 67 1
70 67 68 2
71 68 69 1
72 69 70 1
73 70 71 1
74 71 72 1
75 72 73 1
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