KEGG   DRUG: Valomaciclovir stearateHelp
Entry
D06275                      Drug                                   

Name
Valomaciclovir stearate (USAN)
Formula
C33H58N6O5
Exact mass
618.4469
Mol weight
618.8508
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antiviral, DNA polymerase inhibitor
Comment
Acyclovir type
Treatment of herpes zoster
Target
DNA polymerase [EC:2.7.7.7]
Other DBs
CAS: 
195156-77-5
PubChem: 
LigandBox: 
KCF data Show

ATOM        44
            1   N5x N    42.9800  -17.1500
            2   C8y C    42.9800  -18.4800
            3   N4x N    41.7200  -19.1800
            4   C8y C    40.6000  -18.4800
            5   C8y C    40.6000  -17.1500
            6   C8y C    41.7200  -16.4500
            7   N4y N    39.3400  -18.9000
            8   C8x C    38.5000  -17.7800
            9   N5x N    39.3400  -16.7300
            10  O5x O    41.7200  -15.1200
            11  N1a N    44.1000  -19.1800
            12  C1b C    39.3400  -20.2300
            13  C1c C    38.1500  -20.9300
            14  C1b C    36.9600  -20.2300
            15  C1b C    35.8400  -20.8600
            16  C1b C    38.1500  -23.7300
            17  O7a O    34.7200  -20.2300
            18  C7a C    33.6000  -20.8600
            19  C1c C    32.4100  -20.2300
            20  C1c C    31.2900  -20.8600
            21  C1a C    30.1700  -20.2300
            22  O6a O    33.6000  -22.2600
            23  N1a N    32.4100  -18.9000
            24  C1a C    31.2900  -22.2600
            25  O7a O    36.9600  -24.3600
            26  C7a C    35.8400  -23.7300
            27  C1b C    34.5800  -24.3600
            28  O6a O    35.8400  -22.4000
            29  C1b C    33.3900  -23.6600
            30  C1b C    32.2000  -24.3600
            31  C1b C    30.9400  -23.6600
            32  C1b C    29.7500  -24.3600
            33  C1b C    28.4900  -23.6600
            34  C1b C    27.3000  -24.3600
            35  C1b C    26.0400  -23.6600
            36  C1b C    24.8500  -24.3600
            37  C1b C    23.5900  -23.6600
            38  C1b C    22.4000  -24.3600
            39  C1b C    21.1400  -23.6600
            40  C1b C    19.9500  -24.3600
            41  C1b C    18.6900  -23.6600
            42  C1b C    17.5000  -24.3600
            43  C1b C    16.2400  -23.6600
            44  C1a C    15.0500  -24.3600
BOND        45
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    6  10 2
            12    2  11 1
            13    7  12 1
            14   12  13 1
            15   13  14 1
            16   14  15 1
            17   13  16 1 #Down
            18   15  17 1
            19   17  18 1
            20   18  19 1
            21   19  20 1
            22   20  21 1
            23   18  22 2
            24   19  23 1 #Down
            25   20  24 1
            26   16  25 1
            27   25  26 1
            28   26  28 2
            29   26  27 1
            30   27  29 1
            31   29  30 1
            32   30  31 1
            33   31  32 1
            34   32  33 1
            35   33  34 1
            36   34  35 1
            37   35  36 1
            38   36  37 1
            39   37  38 1
            40   38  39 1
            41   39  40 1
            42   40  41 1
            43   41  42 1
            44   42  43 1
            45   43  44 1

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