KEGG   COMPOUND: C23080
Entry
C23080                      Compound                               
Name
3-Sulfopropionyl-CoA
Formula
C24H40N7O20P3S2
Exact mass
903.0982
Mol weight
903.67
Structure
Reaction
Pathway
map00566  Sulfoquinovose metabolism
Enzyme
1.2.1.-         6.2.1.-
Other DBs
PubChem: 519518011
LinkDB
KCF data

ATOM        56
            1   C1b C    21.9800  -29.2600
            2   C5a C    23.2400  -28.5600
            3   S2a S    24.4300  -29.2600
            4   C1b C    25.6200  -28.5600
            5   C1b C    26.8800  -29.2600
            6   N1b N    28.0700  -28.5600
            7   C5a C    29.2600  -29.2600
            8   C1b C    30.5200  -28.5600
            9   C1b C    31.7100  -29.2600
            10  N1b N    32.9000  -28.5600
            11  C5a C    34.1600  -29.2600
            12  C1c C    35.3500  -28.5600
            13  C1d C    36.5400  -29.2600
            14  C1b C    37.7300  -28.5600
            15  O2b O    38.9900  -29.2600
            16  O5a O    23.2400  -27.1600
            17  O5a O    29.2600  -30.6600
            18  O5a O    34.1600  -30.6600
            19  O1a O    35.3500  -27.1600
            20  C1a C    36.5400  -27.8600
            21  C1a C    36.5400  -30.6600
            22  P1b P    40.3900  -29.2600
            23  O1c O    41.7900  -29.2600
            24  O1c O    40.3900  -30.6600
            25  C1y C    33.8800  -24.2900
            26  C1y C    35.2800  -24.2900
            27  C1y C    35.7000  -22.9600
            28  O2x O    34.5800  -22.1200
            29  C1y C    33.4600  -22.9600
            30  C1b C    37.0300  -22.5400
            31  O1a O    33.0400  -25.4100
            32  O2b O    36.1200  -25.4100
            33  P1b P    37.5200  -25.4100
            34  O1c O    37.5200  -24.0100
            35  O1c O    38.9200  -25.4100
            36  O1c O    37.5200  -26.8100
            37  C8y C    29.3300  -21.1400
            38  C8y C    29.3300  -22.5400
            39  N4y N    31.7800  -22.5400
            40  C8x C    31.7800  -21.1400
            41  N5x N    30.5200  -20.4400
            42  C8y C    28.1400  -20.4400
            43  N5x N    26.8800  -21.1400
            44  C8x C    26.8800  -22.5400
            45  N5x N    28.1400  -23.2400
            46  N1a N    28.1400  -19.0400
            47  O2b O    38.9900  -22.9600
            48  P1b P    40.3900  -22.9600
            49  O1c O    40.3900  -21.5600
            50  O1c O    41.7900  -22.9600
            51  O2c O    40.3900  -26.1800
            52  C1b C    20.7900  -28.5600
            53  S4a S    19.1100  -28.5600
            54  O1d O    19.1100  -27.1600
            55  O1d O    17.5700  -28.5600
            56  O1d O    19.1100  -30.1000
BOND        58
            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   53  55 2
            58   53  56 2

» Japanese version

DBGET integrated database retrieval system