| Entry |
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| Name |
(S)-3-Hydroxybutanoyl-CoA;
(S)-3-Hydroxybutyryl-CoA
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| Formula |
C25H42N7O18P3S
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| Exact mass |
853.1520
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| Mol weight |
853.63
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| Structure |
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| Reaction |
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| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
| map01120 | Microbial metabolism in diverse environments |
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| Module |
| M00032 | Lysine degradation, lysine => saccharopine => acetoacetyl-CoA |
| M00374 | Dicarboxylate-hydroxybutyrate cycle |
| M00375 | Hydroxypropionate-hydroxybutylate cycle |
| M00957 | Lysine degradation, bacteria, L-lysine => glutarate => succinate/acetyl-CoA |
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| Enzyme |
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| Brite |
Lipids [BR:br08002]
FA Fatty acyls
FA07 Fatty esters
FA0705 Fatty acyl CoAs
C01144 (S)-3-Hydroxybutanoyl-CoA
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| Other DBs |
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| KCF data |
ATOM 54
1 C1b C 29.6324 -41.9300
2 C5a C 30.8449 -41.2300
3 S2a S 32.0573 -41.9300
4 C1b C 33.2697 -41.2300
5 C1b C 34.4822 -41.9300
6 N1b N 35.6946 -41.2300
7 C5a C 36.9070 -41.9300
8 C1b C 38.1195 -41.2300
9 C1b C 39.3319 -41.9300
10 N1b N 40.5444 -41.2300
11 C5a C 41.7568 -41.9300
12 C1c C 42.9692 -41.2300
13 C1d C 44.1817 -41.9300
14 C1b C 45.3941 -41.2300
15 O2b O 46.6065 -41.9300
16 O5a O 30.8449 -39.8302
17 O5a O 36.9070 -43.3299
18 O5a O 41.7568 -43.3296
19 O1a O 42.9692 -39.8300
20 C1a C 44.1817 -40.5300
21 C1a C 44.1817 -43.3300
22 P1b P 48.0065 -41.9300
23 O1c O 49.4065 -41.9300
24 O1c O 48.0065 -43.3300
25 C1y C 41.5100 -36.9600
26 C1y C 42.9100 -36.9600
27 C1y C 43.3426 -35.6285
28 O2x O 42.2100 -34.8056
29 C1y C 41.0774 -35.6285
30 C1b C 44.6622 -35.1997
31 O1a O 40.6871 -38.0926
32 O2b O 43.7329 -38.0926
33 P1b P 45.1329 -38.0926
34 O1c O 45.1329 -36.6926
35 O1c O 46.5329 -38.0926
36 O1c O 45.1329 -39.4926
37 C8y C 36.9600 -33.8100
38 C8y C 36.9600 -35.2100
39 N4y N 39.3849 -35.2100
40 C8x C 39.3849 -33.8100
41 N5x N 38.1724 -33.1100
42 C8y C 35.7476 -33.1100
43 N5x N 34.5351 -33.8100
44 C8x C 34.5351 -35.2100
45 N5x N 35.7476 -35.9100
46 N1a N 35.7476 -31.7102
47 O2b O 46.6445 -35.6320
48 P1b P 48.0445 -35.6320
49 O1c O 48.0445 -34.2320
50 O1c O 49.4445 -35.6320
51 O2c O 48.0445 -38.8520
52 C1c C 28.4033 -41.2202
53 C1a C 27.1992 -41.9153
54 O1a O 28.4035 -39.8301
BOND 56
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 52 54 1 #Down
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