KEGG   COMPOUND: C16463Help
Entry
C16463                      Compound                               

Name
3',5'-Cyclic diGMP;
cdiGMP;
3',5'-Cyclic diguanylic acid;
Bis-(3',5')-cyclic diGMP;
Cyclic di-3',5'-guanylate
Formula
C20H24N10O14P2
Exact mass
690.0949
Mol weight
690.4107
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Two-component system
Cell cycle - Caulobacter
Enzyme
2.7.7.65        3.1.4.52
Other DBs
CAS: 
61093-23-0
PubChem: 
ChEBI: 
PDB-CCD: 
NIKKAJI: 
KCF data Show

ATOM        46
            1   C8y C    27.2300  -11.6200
            2   N4y N    26.1800  -10.9200
            3   C8y C    28.4900  -10.7100
            4   N5x N    27.3700  -13.0900
            5   C1y C    24.9200  -11.3400
            6   C8x C    26.6700   -9.5200
            7   N5x N    28.1400   -9.5200
            8   C8y C    29.7500  -11.2700
            9   C8y C    28.7000  -13.6500
            10  O2x O    23.7300  -10.4300
            11  C1y C    24.4300  -12.6000
            12  N4x N    29.8900  -12.7400
            13  O5x O    30.8700  -10.4300
            14  N1a N    28.7000  -15.0500
            15  C1y C    22.6800  -11.2700
            16  C1y C    23.1000  -12.6000
            17  O1a O    25.2700  -13.7200
            18  C1x C    21.3500  -10.8500
            19  O2x O    22.6100  -13.8600
            20  O2x O    20.3000  -11.7600
            21  P1b P    18.9000  -11.7600
            22  O1c O    17.5000  -11.7600
            23  O1c O    18.9000  -10.3600
            24  C8y C    14.2800  -15.4000
            25  N4y N    15.3300  -16.1000
            26  C8y C    13.0200  -16.3100
            27  N5x N    14.1400  -13.9300
            28  C1y C    16.5900  -15.6800
            29  C8x C    14.8400  -17.5000
            30  N5x N    13.3700  -17.5000
            31  C8y C    11.7600  -15.7500
            32  C8y C    12.8100  -13.3700
            33  O2x O    17.7800  -16.5900
            34  C1y C    17.0100  -14.4200
            35  N4x N    11.6200  -14.2800
            36  O5x O    10.6400  -16.5900
            37  N1a N    12.8100  -11.9700
            38  C1y C    18.8300  -15.7500
            39  C1y C    18.4100  -14.4200
            40  O1a O    16.2400  -13.3000
            41  C1x C    20.1600  -16.1700
            42  O2x O    18.9000  -13.1600
            43  O2x O    21.2100  -15.2600
            44  P1b P    22.6100  -15.2600
            45  O1c O    24.0100  -15.2600
            46  O1c O    22.6100  -16.6600
BOND        52
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     5   2 1 #Up
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    5  11 1
            11    8  12 1
            12    8  13 2
            13    9  14 1
            14   10  15 1
            15   11  16 1
            16   11  17 1 #Down
            17   15  18 1 #Up
            18   16  19 1 #Down
            19   18  20 1
            20   20  21 1
            21   21  22 1
            22   21  23 2
            23    6   7 2
            24    9  12 1
            25   15  16 1
            26   24  25 1
            27   24  26 2
            28   24  27 1
            29   28  25 1 #Up
            30   25  29 1
            31   26  30 1
            32   26  31 1
            33   27  32 2
            34   28  33 1
            35   28  34 1
            36   31  35 1
            37   31  36 2
            38   32  37 1
            39   33  38 1
            40   34  39 1
            41   34  40 1 #Down
            42   38  41 1 #Up
            43   39  42 1 #Down
            44   41  43 1
            45   43  44 1
            46   44  19 1
            47   44  45 1
            48   44  46 2
            49   29  30 2
            50   32  35 1
            51   38  39 1
            52   21  42 1

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