KEGG   DRUG: D08646Help
Entry
D08646                      Drug                                   

Name
Triphosadenine (DCF);
ATP
Formula
C10H16N5O13P3
Exact mass
506.9957
Mol weight
507.181
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Vasodilator
Remark
Same as: 
Drug group: 
Interaction
Drug interaction
Brite
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Adenosinetriphosphoric acid
    D08646  Triphosadenine (DCF)
BRITE hierarchy
Other DBs
CAS: 
56-65-5
PubChem: 
PDB-CCD: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        31
            1   N4y N    28.9800  -17.1500
            2   C8y C    30.0300  -17.8500
            3   C1y C    27.7200  -17.5700
            4   C8x C    29.4700  -15.7500
            5   C8y C    31.2900  -16.9400
            6   N5x N    30.1700  -19.2500
            7   O2x O    26.6000  -16.6600
            8   C1y C    27.3000  -18.7600
            9   N5x N    30.9400  -15.7500
            10  C8y C    32.5500  -17.5000
            11  C8x C    31.5000  -19.8800
            12  C1y C    25.4800  -17.5000
            13  C1y C    25.9000  -18.7600
            14  O1a O    28.0700  -19.9500
            15  N5x N    32.6900  -18.9700
            16  N1a N    33.6700  -16.6600
            17  C1b C    24.1500  -17.0800
            18  O1a O    25.4800  -20.0900
            19  O2b O    23.1000  -17.9900
            20  P1b P    21.7000  -17.9900
            21  O2c O    20.3000  -17.9900
            22  O1c O    21.7000  -19.3900
            23  O1c O    21.7000  -16.5900
            24  P1b P    18.9000  -17.9900
            25  O2c O    17.5000  -17.9900
            26  O1c O    18.9000  -19.3900
            27  O1c O    18.9000  -16.5900
            28  P1b P    16.1000  -17.9900
            29  O1c O    16.1000  -19.3900
            30  O1c O    14.7000  -17.9900
            31  O1c O    16.1000  -16.5900
BOND        33
            1     1   2 1
            2     3   1 1 #Up
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13    8  14 1 #Down
            14   10  15 2
            15   10  16 1
            16   12  17 1 #Up
            17   13  18 1 #Down
            18   17  19 1
            19   19  20 1
            20   20  21 1
            21   20  22 1
            22   20  23 2
            23   21  24 1
            24   24  25 1
            25   24  26 1
            26   24  27 2
            27   25  28 1
            28   28  29 1
            29   28  30 1
            30   28  31 2
            31    5   9 1
            32   11  15 1
            33   12  13 1

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