KEGG   DRUG: Cefiderocol sulfate tosylateHelp
Entry
D11013                      Drug                                   

Name
Cefiderocol sulfate tosylate (USAN);
Cefiderocol tosilate sulfate hydrate (JAN);
Cefiderocol sulfate tosilate;
Fetroja (TN);
Fetcroja (TN)
Product
Formula
(C30H34ClN7O10S2)3. (C7H8O3S)4. H2SO4. xH2O
Structure
Mol fileKCF fileDB search
Remark
Chemical structure group: DG02976
Product (DG02976): D11013<US>
Efficacy
Antibacterial, Cell wall biosynthesis inhibitor
Comment
Siderophore cephalosporin
Treatment of complicated urinary tract infections (cUTIs), including pyelonephritis
Target
penicillin binding protein
Brite
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D11013
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D11013
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D11013
BRITE hierarchy
Other DBs
PubChem: 346930791
ChEMBL: CHEMBL4297211
LinkDB All DBs
KCF data Show

ATOM        200
            1   N1y N    24.3600  -17.6400
            2   C1y C    24.3600  -16.2400
            3   S2x S    25.5500  -15.5400
            4   C1x C    26.8100  -16.2400
            5   C2y C    26.8100  -17.6400
            6   C2y C    25.5500  -18.3400
            7   C5x C    22.9600  -17.6400
            8   C1y C    22.9600  -16.2400
            9   C6a C    25.5500  -19.7400
            10  O6a O    24.3600  -20.4400
            11  O6a O    26.7400  -20.4400 #-
            12  O5x O    21.9800  -18.6200
            13  C5a C    20.5800  -16.2400
            14  N1b N    21.7700  -15.5400
            15  C2c C    19.3900  -15.5400
            16  O5a O    20.5800  -17.6400
            17  C8y C    18.2000  -16.2400
            18  N2b N    19.3900  -14.1400
            19  O2a O    20.6500  -13.5100
            20  C1d C    20.6500  -12.1100
            21  N5x N    17.7800  -17.5700
            22  C8y C    16.3800  -17.5700
            23  S2x S    15.8900  -16.2400
            24  C8x C    17.0800  -15.4000
            25  C1b C    28.0000  -18.3400
            26  N2y N    29.1900  -17.6400 #+
            27  C1x C    29.6800  -16.3100
            28  C1x C    31.0800  -16.3100
            29  C1x C    31.5000  -17.6400
            30  C1x C    30.3800  -18.4800
            31  N1a N    15.5400  -18.6900
            32  C1a C    19.2500  -12.1100
            33  C1a C    20.6500  -10.7100
            34  C6a C    22.0500  -12.1100
            35  O6a O    22.7500  -13.3000
            36  O6a O    22.7500  -10.9200
            37  C1b C    29.1900  -19.0400
            38  C1b C    28.0000  -19.7400
            39  N1b N    28.0000  -21.1400
            40  C5a C    26.8100  -21.8400
            41  O5a O    25.5919  -21.1499
            42  C8y C    26.8214  -23.2400
            43  C8x C    25.6062  -23.9548
            44  C8x C    25.6176  -25.3547
            45  C8y C    26.8357  -26.0448
            46  C8y C    28.0509  -25.3300
            47  C8y C    28.0395  -23.9300
            48  X   Cl   29.2641  -23.2092
            49  O1a O    29.2877  -26.0307
            50  O1a O    26.7770  -27.4395
            51  C8x C    38.4300  -14.9800
            52  C8x C    38.4300  -16.3800
            53  C8y C    39.6424  -17.0800
            54  C8x C    40.8549  -16.3800
            55  C8x C    40.8549  -14.9800
            56  C8y C    39.6424  -14.2800
            57  C1a C    39.6424  -18.4798
            58  S4a S    39.6424  -12.8802
            59  O1d O    38.2424  -12.8802
            60  O1d O    41.0424  -12.8802
            61  O1d O    39.6424  -11.4802
            62  S4a S    39.7600  -21.9800
            63  O1d O    39.7600  -23.3800
            64  O1d O    39.7600  -20.5800
            65  O1d O    41.1600  -21.9800
            66  O1d O    38.3600  -21.9800
            67  O0  O    40.4600  -26.2500
            68  N1y N    24.3600  -17.6400
            69  C1y C    24.3600  -16.2400
            70  S2x S    25.5500  -15.5400
            71  C1x C    26.8100  -16.2400
            72  C2y C    26.8100  -17.6400
            73  C2y C    25.5500  -18.3400
            74  C6a C    25.5500  -19.7400
            75  O6a O    24.3600  -20.4400
            76  O6a O    26.7400  -20.4400 #-
            77  C1b C    28.0000  -18.3400
            78  N2y N    29.1900  -17.6400 #+
            79  C1x C    29.6800  -16.3100
            80  C1x C    31.0800  -16.3100
            81  C1x C    31.5000  -17.6400
            82  C1x C    30.3800  -18.4800
            83  C1b C    29.1900  -19.0400
            84  C1b C    28.0000  -19.7400
            85  N1b N    28.0000  -21.1400
            86  C5a C    26.8100  -21.8400
            87  O5a O    25.5919  -21.1499
            88  C8y C    26.8214  -23.2400
            89  C8x C    25.6062  -23.9548
            90  C8x C    25.6176  -25.3547
            91  C8y C    26.8357  -26.0448
            92  C8y C    28.0509  -25.3300
            93  C8y C    28.0395  -23.9300
            94  X   Cl   29.2641  -23.2092
            95  O1a O    29.2877  -26.0307
            96  O1a O    26.7770  -27.4395
            97  C1y C    22.9600  -16.2400
            98  C5x C    22.9600  -17.6400
            99  O5x O    21.9800  -18.6200
            100 N1b N    21.7700  -15.5400
            101 C5a C    20.5800  -16.2400
            102 C2c C    19.3900  -15.5400
            103 C8y C    18.2000  -16.2400
            104 N5x N    17.7800  -17.5700
            105 C8y C    16.3800  -17.5700
            106 S2x S    15.8900  -16.2400
            107 C8x C    17.0800  -15.4000
            108 N1a N    15.5400  -18.6900
            109 N2b N    19.3900  -14.1400
            110 O2a O    20.6500  -13.5100
            111 C1d C    20.6500  -12.1100
            112 C1a C    19.2500  -12.1100
            113 C1a C    20.6500  -10.7100
            114 C6a C    22.0500  -12.1100
            115 O6a O    22.7500  -13.3000
            116 O6a O    22.7500  -10.9200
            117 O5a O    20.5800  -17.6400
            118 N1y N    24.3600  -17.6400
            119 C1y C    24.3600  -16.2400
            120 S2x S    25.5500  -15.5400
            121 C1x C    26.8100  -16.2400
            122 C2y C    26.8100  -17.6400
            123 C2y C    25.5500  -18.3400
            124 C6a C    25.5500  -19.7400
            125 O6a O    24.3600  -20.4400
            126 O6a O    26.7400  -20.4400 #-
            127 C1b C    28.0000  -18.3400
            128 N2y N    29.1900  -17.6400 #+
            129 C1x C    29.6800  -16.3100
            130 C1x C    31.0800  -16.3100
            131 C1x C    31.5000  -17.6400
            132 C1x C    30.3800  -18.4800
            133 C1b C    29.1900  -19.0400
            134 C1b C    28.0000  -19.7400
            135 N1b N    28.0000  -21.1400
            136 C5a C    26.8100  -21.8400
            137 O5a O    25.5919  -21.1499
            138 C8y C    26.8214  -23.2400
            139 C8x C    25.6062  -23.9548
            140 C8x C    25.6176  -25.3547
            141 C8y C    26.8357  -26.0448
            142 C8y C    28.0509  -25.3300
            143 C8y C    28.0395  -23.9300
            144 X   Cl   29.2641  -23.2092
            145 O1a O    29.2877  -26.0307
            146 O1a O    26.7770  -27.4395
            147 C1y C    22.9600  -16.2400
            148 C5x C    22.9600  -17.6400
            149 O5x O    21.9800  -18.6200
            150 N1b N    21.7700  -15.5400
            151 C5a C    20.5800  -16.2400
            152 C2c C    19.3900  -15.5400
            153 C8y C    18.2000  -16.2400
            154 N5x N    17.7800  -17.5700
            155 C8y C    16.3800  -17.5700
            156 S2x S    15.8900  -16.2400
            157 C8x C    17.0800  -15.4000
            158 N1a N    15.5400  -18.6900
            159 N2b N    19.3900  -14.1400
            160 O2a O    20.6500  -13.5100
            161 C1d C    20.6500  -12.1100
            162 C1a C    19.2500  -12.1100
            163 C1a C    20.6500  -10.7100
            164 C6a C    22.0500  -12.1100
            165 O6a O    22.7500  -13.3000
            166 O6a O    22.7500  -10.9200
            167 O5a O    20.5800  -17.6400
            168 C8x C    38.4300  -14.9800
            169 C8x C    38.4300  -16.3800
            170 C8y C    39.6424  -17.0800
            171 C8x C    40.8549  -16.3800
            172 C8x C    40.8549  -14.9800
            173 C8y C    39.6424  -14.2800
            174 S4a S    39.6424  -12.8802
            175 O1d O    38.2424  -12.8802
            176 O1d O    41.0424  -12.8802
            177 O1d O    39.6424  -11.4802
            178 C1a C    39.6424  -18.4798
            179 C8x C    38.4300  -14.9800
            180 C8x C    38.4300  -16.3800
            181 C8y C    39.6424  -17.0800
            182 C8x C    40.8549  -16.3800
            183 C8x C    40.8549  -14.9800
            184 C8y C    39.6424  -14.2800
            185 S4a S    39.6424  -12.8802
            186 O1d O    38.2424  -12.8802
            187 O1d O    41.0424  -12.8802
            188 O1d O    39.6424  -11.4802
            189 C1a C    39.6424  -18.4798
            190 C8x C    38.4300  -14.9800
            191 C8x C    38.4300  -16.3800
            192 C8y C    39.6424  -17.0800
            193 C8x C    40.8549  -16.3800
            194 C8x C    40.8549  -14.9800
            195 C8y C    39.6424  -14.2800
            196 S4a S    39.6424  -12.8802
            197 O1d O    38.2424  -12.8802
            198 O1d O    41.0424  -12.8802
            199 O1d O    39.6424  -11.4802
            200 C1a C    39.6424  -18.4798
BOND        210
            1    62  63 2
            2    62  64 2
            3    62  65 1
            4    62  66 1
            5     1   2 1
            6     2   3 1
            7     3   4 1
            8     4   5 1
            9     5   6 2
            10    1   6 1
            11    1   7 1
            12    7   8 1
            13    2   8 1
            14    6   9 1
            15    9  10 2
            16    9  11 1
            17    7  12 2
            18   13  14 1
            19    8  14 1 #Up
            20   13  15 1
            21   13  16 2
            22   15  17 1
            23   15  18 2
            24   18  19 1
            25   19  20 1
            26   17  21 1
            27   21  22 2
            28   22  23 1
            29   23  24 1
            30   17  24 2
            31    5  25 1
            32   25  26 1
            33   26  27 1
            34   27  28 1
            35   28  29 1
            36   29  30 1
            37   26  30 1
            38   22  31 1
            39   20  32 1
            40   20  33 1
            41   20  34 1
            42   34  35 1
            43   34  36 2
            44   26  37 1
            45   37  38 1
            46   38  39 1
            47   39  40 1
            48   40  41 2
            49   40  42 1
            50   42  43 2
            51   43  44 1
            52   44  45 2
            53   45  46 1
            54   46  47 2
            55   42  47 1
            56   47  48 1
            57   46  49 1
            58   45  50 1
            59   68  69 1
            60   69  70 1
            61   70  71 1
            62   71  72 1
            63   72  73 2
            64   68  73 1
            65   68  98 1
            66   98  97 1
            67   69  97 1
            68   73  74 1
            69   74  75 2
            70   74  76 1
            71   98  99 2
            72  101 100 1
            73   97 100 1 #Up
            74  101 102 1
            75  101 117 2
            76  102 103 1
            77  102 109 2
            78  109 110 1
            79  110 111 1
            80  103 104 1
            81  104 105 2
            82  105 106 1
            83  106 107 1
            84  103 107 2
            85   72  77 1
            86   77  78 1
            87   78  79 1
            88   79  80 1
            89   80  81 1
            90   81  82 1
            91   78  82 1
            92  105 108 1
            93  111 112 1
            94  111 113 1
            95  111 114 1
            96  114 115 1
            97  114 116 2
            98   78  83 1
            99   83  84 1
            100  84  85 1
            101  85  86 1
            102  86  87 2
            103  86  88 1
            104  88  89 2
            105  89  90 1
            106  90  91 2
            107  91  92 1
            108  92  93 2
            109  88  93 1
            110  93  94 1
            111  92  95 1
            112  91  96 1
            113 118 119 1
            114 119 120 1
            115 120 121 1
            116 121 122 1
            117 122 123 2
            118 118 123 1
            119 118 148 1
            120 148 147 1
            121 119 147 1
            122 123 124 1
            123 124 125 2
            124 124 126 1
            125 148 149 2
            126 151 150 1
            127 147 150 1 #Up
            128 151 152 1
            129 151 167 2
            130 152 153 1
            131 152 159 2
            132 159 160 1
            133 160 161 1
            134 153 154 1
            135 154 155 2
            136 155 156 1
            137 156 157 1
            138 153 157 2
            139 122 127 1
            140 127 128 1
            141 128 129 1
            142 129 130 1
            143 130 131 1
            144 131 132 1
            145 128 132 1
            146 155 158 1
            147 161 162 1
            148 161 163 1
            149 161 164 1
            150 164 165 1
            151 164 166 2
            152 128 133 1
            153 133 134 1
            154 134 135 1
            155 135 136 1
            156 136 137 2
            157 136 138 1
            158 138 139 2
            159 139 140 1
            160 140 141 2
            161 141 142 1
            162 142 143 2
            163 138 143 1
            164 143 144 1
            165 142 145 1
            166 141 146 1
            167  51  52 2
            168  52  53 1
            169  53  54 2
            170  54  55 1
            171  55  56 2
            172  51  56 1
            173  53  57 1
            174  56  58 1
            175  58  59 2
            176  58  60 2
            177  58  61 1
            178 168 169 2
            179 169 170 1
            180 170 171 2
            181 171 172 1
            182 172 173 2
            183 168 173 1
            184 170 178 1
            185 173 174 1
            186 174 175 2
            187 174 176 2
            188 174 177 1
            189 179 180 2
            190 180 181 1
            191 181 182 2
            192 182 183 1
            193 183 184 2
            194 179 184 1
            195 181 189 1
            196 184 185 1
            197 185 186 2
            198 185 187 2
            199 185 188 1
            200 190 191 2
            201 191 192 1
            202 192 193 2
            203 193 194 1
            204 194 195 2
            205 190 195 1
            206 192 200 1
            207 195 196 1
            208 196 197 2
            209 196 198 2
            210 196 199 1
BRACKET     1    13.5100  -28.7000   13.5100   -8.8200
            1    32.2000   -8.8200   32.2000  -28.7000
            1  3
 ORIGINAL  1    1   2   3   4   5   6   9  10  11  26  27  28  29  30  31  38
            1   39  40  41  42  43  44  45  46  47  48  49  50  51   8   7  12
            1   15  14  16  18  22  23  24  25  32  19  20  21  33  34  35  36
            1   37  17  13
 REPEAT    1   69  70  71  72  73  74  75  76  77  78  79  80  81  82  83  84
            1   85  86  87  88  89  90  91  92  93  94  95  96  97  98  99 100
            1  101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116
            1  117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132
            1  133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148
            1  149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164
            1  165 166 167 168 169 170
            2    37.0300  -19.3200   37.0300  -10.3600
            2    42.2800  -10.3600   42.2800  -19.3200
            2  4
 ORIGINAL  2   52  53  54  55  56  57  59  60  61  62  58
 REPEAT    2  171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186
            2  187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202
            2  203
            3    38.2200  -27.1600   38.2200  -25.1300
            3    41.0900  -25.1300   41.0900  -27.1600
            3  x
 ORIGINAL  3   68
 REPEAT    3

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