KEGG   DRUG: Modithromycin
Entry
D09642                      Drug                                   
Name
Modithromycin (USAN/INN)
Formula
C43H64N6O11
Exact mass
840.4633
Mol weight
841.00
Structure
Class
Antibacterial
 DG01551  Macrolide antibiotic
Efficacy
Antibacterial, Protein biosynthesis inhibitor
Comment
Bridged bicyclic macrolide
Target
50S ribosomal subunit
  Pathway
ko03010  Ribosome
Interaction
Brite
Drug groups [BR:br08330]
 Antibacterial
  DG01551  Macrolide antibiotic
   D09642  Modithromycin
Antimicrobials [BR:br08307]
 Antibacterials
  Protein biosynthesis inhibitor
   Macrolide
    D09642  Modithromycin (USAN/INN)
Other DBs
PubChem: 124490382
LigandBox: D09642
LinkDB
KCF data

ATOM        60
            1   C1y C    21.5600  -30.3100
            2   C1z C    21.5600  -28.9800
            3   C1y C    20.3700  -31.0100
            4   O2a O    23.1700  -31.7100
            5   C1x C    20.3700  -28.3500
            6   C5x C    20.3700  -32.3400
            7   C1a C    19.3900  -29.9600
            8   C1y C    20.3700  -26.9500
            9   C1y C    19.1800  -33.0400
            10  C2y C    19.1800  -26.3200
            11  C1a C    21.5600  -26.3200
            12  C7x C    17.9900  -32.3400
            13  C1a C    19.1800  -34.4400
            14  C1y C    17.9900  -26.9500
            15  N2b N    19.1800  -24.9200
            16  O7x O    17.9900  -31.0100
            17  O6a O    16.9400  -33.3200
            18  C1y C    17.9900  -28.3500
            19  C1a C    16.8700  -26.3200
            20  C1y C    16.8700  -30.3100
            21  C1z C    16.8700  -28.9800
            22  O2x O    19.1800  -28.3500
            23  C1b C    15.6800  -31.0100
            24  C1a C    15.6100  -29.5400
            25  O1a O    15.6100  -28.3500
            26  C1a C    15.6800  -32.1300
            27  C5a C    20.3700  -24.2200
            28  C1a C    21.5600  -24.9200
            29  O5a O    20.3700  -22.8200
            30  O5x O    21.5600  -33.0400
            31  C1x C    20.7900  -27.6500
            32  C2y C    22.8900  -27.6500
            33  O2x O    22.8900  -28.9800
            34  C1x C    24.0800  -28.3500
            35  N2b N    24.0800  -26.9500
            36  O2a O    24.0800  -25.5500
            37  C1b C    25.2700  -24.8500
            38  C1a C    22.6100  -29.9600
            39  C8y C    26.4600  -25.5500
            40  C8x C    26.4600  -26.9500
            41  C8x C    27.6500  -27.6500
            42  C8y C    28.8400  -26.9500
            43  N5x N    28.8400  -25.5500
            44  C8x C    27.6500  -24.8500
            45  N4y N    30.1000  -27.6500
            46  N5x N    30.2400  -28.9800
            47  C8x C    31.5700  -29.2600
            48  C8x C    32.2700  -28.0700
            49  C8x C    31.3600  -27.0900
            50  C1y C    24.9200  -31.9900
            51  C1y C    24.9200  -33.3900
            52  C1y C    26.1324  -34.0900
            53  C1x C    27.3449  -33.3900
            54  C1y C    27.3449  -31.9900
            55  O2x O    26.1324  -31.2900
            56  C1a C    28.5760  -31.2790
            57  O1a O    23.7076  -34.0900
            58  N1c N    26.1324  -35.4898
            59  C1a C    24.9032  -36.1997
            60  C1a C    27.3280  -36.1802
BOND        64
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     3   6 1
            6     3   7 1 #Down
            7     5   8 1
            8     6   9 1
            9     8  10 1
            10    8  11 1 #Down
            11    9  12 1
            12    9  13 1 #Up
            13   10  14 1
            14   10  15 2
            15   12  16 1
            16   12  17 2
            17   14  18 1
            18   14  19 1 #Up
            19   16  20 1
            20   18  21 1
            21   18  22 1
            22   20  23 1 #Down
            23   21  24 1 #Down
            24   21  25 1 #Up
            25   23  26 1
            26   20  21 1
            27   15  27 1
            28   27  28 1
            29   27  29 2
            30    6  30 2
            31   22  31 1
            32   31  32 1
            33    2  33 1
            34   32  34 1
            35   33  34 1
            36   35  32 2
            37   35  36 1
            38   36  37 1
            39    2  38 1 #Down
            40   37  39 1
            41   39  40 2
            42   40  41 1
            43   41  42 2
            44   42  43 1
            45   43  44 2
            46   39  44 1
            47   42  45 1
            48   45  46 1
            49   46  47 2
            50   47  48 1
            51   48  49 2
            52   45  49 1
            53   50  51 1
            54   51  52 1
            55   52  53 1
            56   53  54 1
            57   54  55 1
            58   50  55 1
            59   50   4 1 #Down
            60   54  56 1 #Down
            61   51  57 1 #Up
            62   52  58 1 #Down
            63   58  59 1
            64   58  60 1

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