 | | COMPOUND: C21943 | |
| Entry |
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| Name |
Sapienoyl-CoA;
(6Z)-Hexadecenoyl-CoA
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| Formula |
C37H64N7O17P3S
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| Exact mass |
1003.3292
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| Mol weight |
1003.927
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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
C21943 (6Z)-Hexadecenoyl-CoA
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| Other DBs |
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| KCF data |
ATOM 65
1 C1b C 23.0524 -20.4400
2 C5a C 24.2649 -19.7400
3 S2a S 25.4773 -20.4400
4 C1b C 26.6897 -19.7400
5 C1b C 27.9022 -20.4400
6 N1b N 29.1146 -19.7400
7 C5a C 30.3270 -20.4400
8 C1b C 31.5395 -19.7400
9 C1b C 32.7519 -20.4400
10 N1b N 33.9644 -19.7400
11 C5a C 35.1768 -20.4400
12 C1c C 36.3892 -19.7400
13 C1d C 37.6017 -20.4400
14 C1b C 38.8141 -19.7400
15 O2b O 40.0265 -20.4400
16 O5a O 24.2649 -18.3402
17 O5a O 30.3270 -21.8399
18 O5a O 35.1768 -21.8396
19 O1a O 36.3892 -18.3400
20 C1a C 37.6017 -19.0400
21 C1a C 37.6017 -21.8400
22 P1b P 41.4265 -20.4400
23 O1c O 42.8265 -20.4400
24 O1c O 41.4265 -21.8400
25 C1y C 34.9300 -15.4700
26 C1y C 36.3300 -15.4700
27 C1y C 36.7626 -14.1385
28 O2x O 35.6300 -13.3156
29 C1y C 34.4974 -14.1385
30 C1b C 38.0822 -13.7097
31 O1a O 34.1071 -16.6026
32 O2b O 37.1529 -16.6026
33 P1b P 38.5529 -16.6026
34 O1c O 38.5529 -15.2026
35 O1c O 39.9529 -16.6026
36 O1c O 38.5529 -18.0026
37 C8y C 30.3800 -12.3200
38 C8y C 30.3800 -13.7200
39 N4y N 32.8049 -13.7200
40 C8x C 32.8049 -12.3200
41 N5x N 31.5924 -11.6200
42 C8y C 29.1676 -11.6200
43 N5x N 27.9551 -12.3200
44 C8x C 27.9551 -13.7200
45 N5x N 29.1676 -14.4200
46 N1a N 29.1676 -10.2202
47 O2b O 40.0645 -14.1420
48 P1b P 41.4645 -14.1420
49 O1c O 41.4645 -12.7420
50 O1c O 42.8645 -14.1420
51 O2c O 41.4645 -17.3620
52 C1b C 21.8176 -19.7400
53 C1b C 20.6051 -20.4400
54 C1b C 19.3927 -19.7400
55 C2b C 18.1803 -20.4400
56 C2b C 16.7803 -20.4400
57 C1b C 15.5876 -19.7400
58 C1b C 14.3751 -20.4400
59 C1b C 13.1627 -19.7400
60 C1b C 11.9503 -20.4400
61 C1b C 10.7378 -19.7400
62 C1b C 9.5254 -20.4400
63 C1b C 8.3130 -19.7400
64 C1b C 7.1005 -20.4400
65 C1a C 5.8654 -19.7266
BOND 67
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 13 14 1
14 14 15 1
15 2 16 2
16 7 17 2
17 11 18 2
18 12 19 1 #Down
19 13 20 1
20 13 21 1
21 15 22 1
22 22 23 2
23 22 24 1
24 25 26 1
25 26 27 1
26 27 28 1
27 28 29 1
28 25 29 1
29 27 30 1 #Down
30 25 31 1 #Up
31 26 32 1 #Up
32 32 33 1
33 33 34 1
34 33 35 1
35 33 36 2
36 37 38 2
37 38 39 1
38 39 40 1
39 40 41 2
40 37 41 1
41 37 42 1
42 42 43 2
43 43 44 1
44 44 45 2
45 38 45 1
46 42 46 1
47 29 39 1 #Down
48 30 47 1
49 47 48 1
50 48 49 1
51 48 50 2
52 48 51 1
53 22 51 1
54 1 52 1
55 52 53 1
56 53 54 1
57 54 55 1
58 55 56 2
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 62 63 1
66 63 64 1
67 64 65 1
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