KEGG   COMPOUND: C03561Help
Entry
C03561                      Compound                               

Name
(R)-3-Hydroxybutanoyl-CoA;
(3R)-3-Hydroxybutanoyl-CoA
Formula
C25H42N7O18P3S
Exact mass
853.152
Mol weight
853.6234
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Fatty acid degradation
Glyoxylate and dicarboxylate metabolism
Butanoate metabolism
Microbial metabolism in diverse environments
Carbon metabolism
Module
M00373  
Ethylmalonyl pathway
Enzyme
1.1.1.36        2.3.1.-         4.2.1.55        5.1.2.3
Other DBs
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        54
            1   C1b C    15.4924  -20.3000
            2   C5a C    16.7049  -19.6000
            3   S2a S    17.9173  -20.3000
            4   C1b C    19.1297  -19.6000
            5   C1b C    20.3422  -20.3000
            6   N1b N    21.5546  -19.6000
            7   C5a C    22.7670  -20.3000
            8   C1b C    23.9795  -19.6000
            9   C1b C    25.1919  -20.3000
            10  N1b N    26.4044  -19.6000
            11  C5a C    27.6168  -20.3000
            12  C1c C    28.8292  -19.6000
            13  C1d C    30.0417  -20.3000
            14  C1b C    31.2541  -19.6000
            15  O2b O    32.4665  -20.3000
            16  O5a O    16.7049  -18.2002
            17  O5a O    22.7670  -21.6999
            18  O5a O    27.6168  -21.6996
            19  O1a O    28.8292  -18.2000
            20  C1a C    30.0417  -18.9000
            21  C1a C    30.0417  -21.7000
            22  P1b P    33.8665  -20.3000
            23  O1c O    35.2665  -20.3000
            24  O1c O    33.8665  -21.7000
            25  C1y C    27.3700  -15.3300
            26  C1y C    28.7700  -15.3300
            27  C1y C    29.2026  -13.9985
            28  O2x O    28.0700  -13.1756
            29  C1y C    26.9374  -13.9985
            30  C1b C    30.5222  -13.5697
            31  O1a O    26.5471  -16.4626
            32  O2b O    29.5929  -16.4626
            33  P1b P    30.9929  -16.4626
            34  O1c O    30.9929  -15.0626
            35  O1c O    32.3929  -16.4626
            36  O1c O    30.9929  -17.8626
            37  C8y C    22.8200  -12.1800
            38  C8y C    22.8200  -13.5800
            39  N4y N    25.2449  -13.5800
            40  C8x C    25.2449  -12.1800
            41  N5x N    24.0324  -11.4800
            42  C8y C    21.6076  -11.4800
            43  N5x N    20.3951  -12.1800
            44  C8x C    20.3951  -13.5800
            45  N5x N    21.6076  -14.2800
            46  N1a N    21.6076  -10.0802
            47  O2b O    32.5045  -14.0020
            48  P1b P    33.9045  -14.0020
            49  O1c O    33.9045  -12.6020
            50  O1c O    35.3045  -14.0020
            51  O2c O    33.9045  -17.2220
            52  C1c C    14.2576  -19.6000
            53  C1a C    13.0451  -20.3000
            54  O1a O    14.2520  -18.2003
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 #Up

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