Entry |
|
Name |
trans-Tetradec-2-enoyl-CoA;
(2E)-Tetradecenoyl-CoA
|
Formula |
C35H60N7O17P3S
|
Exact mass |
975.2979
|
Mol weight |
975.88
|
Structure |
|
Reaction |
|
Pathway |
|
Module |
M00085 | Fatty acid elongation in mitochondria |
|
Enzyme |
|
Brite |
Lipids [BR:br08002]
FA Fatty acyls
FA07 Fatty esters
FA0705 Fatty acyl CoAs
C05273 (2E)-Tetradecenoyl-CoA
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 63
1 S2a S 21.1373 -20.5800
2 C1b C 22.3497 -19.8800
3 C1b C 23.5622 -20.5800
4 N1b N 24.7746 -19.8800
5 C5a C 25.9870 -20.5800
6 C1b C 27.1995 -19.8800
7 C1b C 28.4119 -20.5800
8 N1b N 29.6244 -19.8800
9 C5a C 30.8368 -20.5800
10 C1c C 32.0492 -19.8800
11 C1d C 33.2617 -20.5800
12 C1b C 34.4741 -19.8800
13 O2b O 35.6865 -20.5800
14 O5a O 25.9870 -21.9799
15 O5a O 30.8368 -21.9796
16 O1a O 32.0492 -18.4800
17 C1a C 33.2617 -19.1800
18 C1a C 33.2617 -21.9800
19 P1b P 37.0865 -20.5800
20 O1c O 38.4865 -20.5800
21 O1c O 37.0865 -21.9800
22 C1y C 30.5900 -15.6100
23 C1y C 31.9900 -15.6100
24 C1y C 32.4226 -14.2785
25 O2x O 31.2900 -13.4556
26 C1y C 30.1574 -14.2785
27 C1b C 33.7422 -13.8497
28 O1a O 29.7671 -16.7426
29 O2b O 32.8129 -16.7426
30 P1b P 34.2129 -16.7426
31 O1c O 34.2129 -15.3426
32 O1c O 35.6129 -16.7426
33 O1c O 34.2129 -18.1426
34 C8y C 26.0400 -12.4600
35 C8y C 26.0400 -13.8600
36 N4y N 28.4649 -13.8600
37 C8x C 28.4649 -12.4600
38 N5x N 27.2524 -11.7600
39 C8y C 24.8276 -11.7600
40 N5x N 23.6151 -12.4600
41 C8x C 23.6151 -13.8600
42 N5x N 24.8276 -14.5600
43 N1a N 24.8276 -10.3602
44 O2b O 35.7245 -14.2820
45 P1b P 37.1245 -14.2820
46 O1c O 37.1245 -12.8820
47 O1c O 38.5245 -14.2820
48 O2c O 37.1245 -17.5020
49 C5a C 19.9276 -19.8800
50 C2b C 18.7151 -20.5800
51 C2b C 17.5027 -19.8800
52 C1b C 16.2903 -20.5800
53 C1b C 15.0778 -19.8800
54 C1b C 13.8654 -20.5800
55 C1b C 12.6530 -19.8800
56 C1b C 11.4405 -20.5800
57 C1b C 10.2281 -19.8800
58 C1b C 9.0156 -20.5800
59 C1b C 7.8032 -19.8800
60 C1b C 6.5908 -20.5800
61 C1b C 5.3783 -19.8800
62 C1a C 4.1659 -20.5800
63 O5a O 19.9282 -18.4802
BOND 65
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 1
53 50 51 2
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 1
62 59 60 1
63 60 61 1
64 61 62 1
65 49 63 2
|