KEGG   DRUG: Butikacin
Entry
D03190                      Drug                                   

Name
Butikacin (USAN/INN)
Formula
C22H45N5O12
Exact mass
571.3065
Mol weight
571.619
Structure
Simcomp
Class
Antibacterial
 DG01447  Aminoglycoside antibiotic
Efficacy
Antibacterial
Interaction
Other DBs
CAS: 59733-86-7
PubChem: 17397344
ChEMBL: CHEMBL2304044
LigandBox: D03190
NIKKAJI: J17.983C
LinkDB
KCF data

ATOM        39
            1   C1y C    16.3800  -20.1600
            2   C1y C    16.3800  -21.5600
            3   C1y C    17.5700  -22.2600
            4   C1y C    18.8300  -21.5600
            5   C1y C    18.8300  -20.1600
            6   O2x O    17.5700  -19.4600
            7   O2a O    20.0200  -19.4600
            8   C1y C    21.2100  -18.7600
            9   C1y C    22.4000  -19.4600
            10  C1x C    23.6600  -18.7600
            11  C1y C    23.6600  -17.3600
            12  C1y C    22.4000  -16.6600
            13  C1y C    21.2100  -17.3600
            14  O2a O    22.4000  -15.2600
            15  C1y C    23.5900  -14.5600
            16  C1b C    15.1900  -19.4600
            17  O1a O    14.0000  -20.1600
            18  O1a O    15.1900  -22.2600
            19  N1a N    17.5700  -23.6600
            20  O1a O    20.0200  -22.2600
            21  N1b N    22.4000  -20.8600
            22  C1b C    23.5900  -21.5600
            23  C1c C    24.8500  -20.8600
            24  C1b C    26.0400  -21.5600
            25  C1b C    27.2300  -20.8600
            26  N1a N    28.4900  -21.5600
            27  O2x O    24.8500  -15.2600
            28  C1y C    26.0400  -14.5600
            29  C1y C    26.0400  -13.1600
            30  C1y C    24.7800  -12.4600
            31  C1y C    23.5900  -13.1600
            32  C1b C    27.3000  -15.2600
            33  N1a N    27.3000  -16.6600
            34  O1a O    27.2300  -12.3900
            35  O1a O    24.7800  -11.0600
            36  O1a O    22.4000  -12.4600
            37  O1a O    24.8500  -19.4600
            38  N1a N    24.7800  -16.6600
            39  O1a O    20.0200  -16.6600
BOND        41
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     5   7 1 #Down
            8     8   7 1 #Down
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14    8  13 1
            15   12  14 1 #Down
            16   15  14 1 #Down
            17    1  16 1 #Up
            18   16  17 1
            19    2  18 1 #Down
            20    3  19 1 #Up
            21    4  20 1 #Down
            22    9  21 1 #Up
            23   21  22 1
            24   22  23 1
            25   23  24 1
            26   24  25 1
            27   25  26 1
            28   15  27 1
            29   27  28 1
            30   28  29 1
            31   29  30 1
            32   30  31 1
            33   15  31 1
            34   28  32 1 #Up
            35   32  33 1
            36   29  34 1 #Down
            37   30  35 1 #Up
            38   31  36 1 #Down
            39   23  37 1 #Up
            40   11  38 1 #Up
            41   13  39 1 #Up

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