KEGG   DRUG: Edotreotide gallium Ga-68Help
Entry
D11651                      Drug                                   

Name
Edotreotide gallium Ga-68;
Ga 68 Dotatoc (TN)
Product
Formula
C65H92N14O18S2. Ga
Exact mass
1488.5435
Mol weight
1491.362
Structure
Mol fileKCF fileDB search
Remark
Product: D11651<US>
Efficacy
Diagnostic aid (tumor), Radioactive agent
Comment
Indicated for use with positron emission tomography (PET) for the localization of somatostatin receptor positive neuroendocrine tumors (NETs)
Brite
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D11651
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D11651
BRITE hierarchy
LinkDB All DBs
KCF data Show

ATOM        100
            1   C1y C    16.3963  -16.1160
            2   C5x C    16.3963  -17.4474
            3   N1x N    17.5174  -18.2181
            4   S3x S    18.7787  -16.1160
            5   C1x C    17.5174  -15.4153
            6   C1x C    21.0910  -16.1160
            7   S3x S    19.8998  -15.4153
            8   O5x O    22.3522  -18.2181
            9   O5x O    23.4733  -17.4474
            10  N1x N    23.4733  -16.1160
            11  C1y C    22.3522  -15.4153
            12  C5x C    24.6645  -18.2181
            13  N1x N    25.9258  -17.4474
            14  C1y C    25.9258  -16.1160
            15  C5x C    24.6645  -15.4153
            16  C5x C    22.3522  -19.5494
            17  N1x N    23.4733  -20.1801
            18  C1y C    24.6645  -19.5494
            19  N1x N    19.8998  -19.5494
            20  C1y C    21.0910  -20.1801
            21  C1y C    17.5174  -19.5494
            22  C5x C    18.7787  -20.1801
            23  C5a C    22.3522  -14.0840
            24  O5a O    23.4733  -13.3833
            25  N1b N    21.1610  -13.3833
            26  C1c C    21.1610  -11.9819
            27  C1b C    22.3522  -11.2812
            28  C1c C    19.9699  -11.2812
            29  O1a O    23.4733  -11.9819
            30  C1a C    18.8487  -11.9819
            31  O1a O    19.9699   -9.8798
            32  O5x O    24.6645  -14.0840
            33  C1c C    27.1170  -15.4153
            34  C1a C    28.2381  -16.1160
            35  O1a O    27.1170  -14.0840
            36  C1b C    25.8557  -20.1801
            37  C1b C    27.0469  -19.5494
            38  C1b C    28.1680  -20.1801
            39  C1b C    29.3592  -19.5494
            40  N1a N    30.4803  -20.1801
            41  C1b C    21.0910  -21.6515
            42  O5x O    18.7787  -21.6515
            43  C1b C    16.3963  -20.1801
            44  C8y C    16.3963  -21.6515
            45  C8x C    15.2051  -22.2822
            46  C8x C    15.2051  -23.6836
            47  C8y C    16.3963  -24.3843
            48  C8x C    17.5174  -23.6836
            49  C8x C    17.5174  -22.2822
            50  O1a O    16.3963  -25.7156
            51  O5x O    15.2051  -18.2181
            52  N1b N    15.2051  -15.4153
            53  C5a C    14.0139  -16.1160
            54  C1c C    12.8228  -15.4153
            55  O5a O    14.0139  -17.4474
            56  C1b C    11.7016  -16.1160
            57  C8y C    11.7016  -17.4474
            58  C8x C    10.4404  -18.2181
            59  C8x C    10.4404  -19.5494
            60  C8x C    11.7016  -20.1801
            61  C8x C    12.8228  -19.5494
            62  C8x C    12.8228  -18.2181
            63  C8y C    22.3522  -22.3522
            64  C8y C    22.8427  -23.7536
            65  C8y C    24.3142  -23.7536
            66  N4x N    24.7346  -22.2822
            67  C8x C    23.4733  -21.5114
            68  C8x C    22.1420  -24.9448
            69  C8x C    22.8427  -26.2061
            70  C8x C    24.3142  -26.2061
            71  C8x C    25.0149  -24.9448
            72  N1b N    12.8228  -14.0139
            73  C5a C    14.0840  -13.3132
            74  O5a O    15.2752  -14.0139
            75  C1b C    14.0840  -11.8418
            76  N1y N    12.8228  -11.1411
            77  C1x C    11.9118  -12.8928
            78  C1x C    10.6506  -12.8928
            79  N1y N    10.4404  -11.6316
            80  C1x C     9.1791  -11.1411
            81  C1x C     9.1791   -9.9499
            82  C1x C    14.7847  -10.3703
            83  C1x C    14.7847   -9.0390
            84  N1y N    13.5235   -8.6886
            85  C1x C    13.2432   -7.3573
            86  C1x C    12.0520   -7.3573
            87  N1y N    10.9309   -9.0390
            88  C1b C    14.7847   -7.9879
            89  C6a C    15.9759   -8.6886
            90  O6a O    17.2371   -7.9879
            91  O6a O    15.9759  -10.0900
            92  C6a C     7.9879  -11.6316
            93  C1b C     9.2492  -12.3323
            94  O6a O     6.7968  -12.3323
            95  O6a O     7.9879  -10.1601
            96  C1b C     9.7397   -8.3383
            97  C6a C     9.7397   -6.8668
            98  O6a O    10.9309   -6.1661
            99  O6a O     8.5485   -6.1661
            100 Z   Ga   11.2700  -10.4300
BOND        104
            1     1   2 1
            2     2   3 1
            3     4   5 1
            4     1   5 1
            5     6   7 1
            6     4   7 1
            7    10  11 1
            8     6  11 1
            9     9  12 2
            10   12  13 1
            11   13  14 1
            12   14  15 1
            13   10  15 1
            14    8  16 2
            15   16  17 1
            16   17  18 1
            17   18  12 1
            18   19  20 1
            19   16  20 1
            20    3  21 1
            21   21  22 1
            22   19  22 1
            23   11  23 1
            24   23  24 2
            25   23  25 1
            26   25  26 1
            27   26  27 1 #Up
            28   26  28 1
            29   27  29 1
            30   28  30 1
            31   28  31 1 #Up
            32   15  32 2
            33   14  33 1
            34   33  34 1
            35   33  35 1
            36   18  36 1
            37   36  37 1
            38   37  38 1
            39   38  39 1
            40   39  40 1
            41   20  41 1
            42   22  42 2
            43   21  43 1
            44   43  44 1
            45   44  45 2
            46   45  46 1
            47   46  47 2
            48   47  48 1
            49   48  49 2
            50   44  49 1
            51   47  50 1
            52    2  51 2
            53    1  52 1
            54   52  53 1
            55   53  54 1
            56   53  55 2
            57   54  56 1
            58   56  57 1
            59   57  58 2
            60   58  59 1
            61   59  60 2
            62   60  61 1
            63   61  62 2
            64   57  62 1
            65   41  63 1
            66   63  64 1
            67   64  65 2
            68   65  66 1
            69   66  67 1
            70   63  67 2
            71   64  68 1
            72   68  69 2
            73   69  70 1
            74   70  71 2
            75   65  71 1
            76   54  72 1
            77   72  73 1
            78   73  74 2
            79   73  75 1
            80   75  76 1
            81   80  81 1
            82   81  87 1
            83   77  78 1
            84   82  83 1
            85   83  84 1
            86   78  79 1
            87   84  85 1
            88   85  86 1
            89   79  80 1
            90   86  87 1
            91   77  76 1
            92   82  76 1
            93   88  89 1
            94   88  84 1
            95   89  90 1
            96   89  91 2
            97   92  93 1
            98   93  79 1
            99   92  94 1
            100  92  95 2
            101  87  96 1
            102  96  97 1
            103  97  98 1
            104  97  99 2

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