KEGG   DRUG: Leuprolide mesylate
Entry
D12337                      Drug                                   
Name
Leuprolide mesylate (USAN);
Leuprorelin mesylate;
Leuprorelin mesilate;
Camcevi (TN)
Product
CAMCEVI (Accord BioPharma), CAMCEVI (Accord BioPharma)
Formula
C59H84N16O12. (CH4SO3)x
Structure
Class
Hormonal agent
 DG01494  Gonadotropin-releasing hormone receptor agonist
Remark
ATC code: L02AE02
Chemical structure group: DG00730
Product (DG00730): D00989<JP/US> D12337<US>
Efficacy
Antineoplastic, Gonadotropin-releasing hormone receptor agonist
  Disease
Prostate cancer [DS:H00024]
Target
GNRHR [HSA:2798] [KO:K04280]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04912  GnRH signaling pathway
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L02 ENDOCRINE THERAPY
   L02A HORMONES AND RELATED AGENTS
    L02AE Gonadotropin releasing hormone analogues
     L02AE02 Leuprorelin
      D12337  Leuprolide mesylate (USAN) <US>
Drug groups [BR:br08330]
 Hormonal agent
  DG01494  Gonadotropin-releasing hormone receptor agonist
   DG00730  Leuprorelin
    D12337  Leuprolide mesylate
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Gonadotropin-releasing hormone
    GNRHR
     D12337  Leuprolide mesylate (USAN) <US>
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D12337
Drug groups [BR:br08330]
 Hormonal agent
  DG01494  Gonadotropin-releasing hormone receptor agonist
   DG00730  Leuprorelin
Other DBs
CAS: 1401513-74-3
PubChem: 497620750
LinkDB
KCF data

ATOM        92
            1   C1c C    11.3388  -15.7484
            2   N1b N    10.1490  -16.3784
            3   C5a C    12.5988  -16.3784
            4   C5a C     8.9591  -15.7484
            5   N1b N    13.7187  -15.6785
            6   O5a O    12.5988  -17.7082
            7   C1c C     7.7693  -16.4483
            8   O5a O     8.9591  -14.2785
            9   C1c C    14.9085  -16.3083
            10  N1b N     6.5093  -15.7484
            11  C5a C    16.1683  -15.6785
            12  C5a C     5.3195  -16.4483
            13  N1b N    17.3583  -16.3083
            14  O5a O    16.1683  -14.2085
            15  C1y C     4.1296  -15.8184
            16  O5a O     5.3195  -17.8482
            17  C1c C    18.5482  -15.6084
            18  C1x C     2.8697  -16.2384
            19  N1x N     4.1296  -14.3486
            20  C1b C    18.5482  -14.2085
            21  C5a C    19.7380  -16.3083
            22  C1x C     2.0299  -15.0485
            23  C5x C     2.8697  -13.9986
            24  C8y C    19.6681  -13.5086
            25  N1b N    20.9979  -15.6084
            26  O5a O    19.7380  -17.7082
            27  O5x O     2.3798  -12.6687
            28  C8x C    20.9979  -14.1386
            29  C8x C    19.6681  -12.1088
            30  C1c C    22.2578  -16.3083
            31  C8x C    22.1878  -13.4387
            32  C8x C    20.9279  -11.4089
            33  C5a C    23.4476  -15.6084
            34  C8y C    22.1878  -12.1088
            35  N1b N    24.6375  -16.3083
            36  O5a O    23.4476  -14.1386
            37  O1a O    23.3077  -11.4089
            38  C1c C    25.8274  -15.6084
            39  C5a C    27.0173  -16.2384
            40  N1b N    28.2072  -15.5384
            41  O5a O    27.0173  -17.6382
            42  C1c C    29.3970  -16.2384
            43  C5a C    30.6569  -15.5384
            44  C1b C    29.3970  -17.6382
            45  N1y N    31.9168  -16.1684
            46  O5a O    30.6569  -14.0685
            47  C1y C    33.2466  -16.1684
            48  C1x C    31.4968  -17.4982
            49  C1x C    33.6666  -17.4982
            50  C5a C    34.5765  -15.4685
            51  C1x C    32.5467  -18.2682
            52  N1b N    35.8363  -16.2384
            53  O5a O    34.5765  -13.9286
            54  C1b C    11.3388  -14.2785
            55  C8y C    12.6687  -13.6486
            56  C8y C    13.0887  -12.3887
            57  C8x C    13.7886  -14.4185
            58  C8y C    14.4186  -12.3887
            59  C8x C    12.3888  -11.1989
            60  N4x N    14.9085  -13.6486
            61  C8x C    15.1185  -11.1289
            62  C8x C    13.0887   -9.9389
            63  C8x C    14.4186   -9.9389
            64  C1b C     7.7693  -17.8482
            65  C8y C     8.9591  -18.5481
            66  C8x C     8.9591  -19.9480
            67  N5x N    10.2189  -20.4379
            68  C8x C    11.0589  -19.3180
            69  N4x N    10.3590  -18.1281
            70  C1b C    14.9085  -17.7082
            71  O1a O    16.1683  -18.4081
            72  C1b C    22.2578  -17.7082
            73  C1c C    23.5177  -18.4081
            74  C1a C    24.7075  -17.6382
            75  C1a C    23.5177  -19.8080
            76  C1b C    25.8274  -14.1386
            77  C1c C    27.0173  -13.4387
            78  C1a C    28.2771  -14.2085
            79  C1a C    27.0173  -12.0388
            80  C1b C    37.0963  -15.5384
            81  C1a C    38.2861  -16.2384
            82  C1b C    30.6569  -18.3381
            83  C1b C    30.6569  -19.8080
            84  N1b N    29.3970  -20.5079
            85  C2c C    28.2072  -19.8080
            86  N1a N    27.0173  -20.5079
            87  N2a N    28.2072  -18.3381
            88  S4a S    37.3262  -21.1490
            89  C1a C    35.9255  -21.1490
            90  O1d O    38.7268  -21.1490
            91  O1d O    37.3262  -19.7484
            92  O1d O    37.3262  -22.5496
BOND        96
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     3   6 2
            6     4   7 1
            7     4   8 2
            8     5   9 1
            9     7  10 1
            10    9  11 1
            11   10  12 1
            12   11  13 1
            13   11  14 2
            14   15  12 1 #Down
            15   12  16 2
            16   13  17 1
            17   15  18 1
            18   15  19 1
            19   17  20 1 #Up
            20   17  21 1
            21   18  22 1
            22   19  23 1
            23   20  24 1
            24   21  25 1
            25   21  26 2
            26   23  27 2
            27   24  28 2
            28   24  29 1
            29   25  30 1
            30   28  31 1
            31   29  32 2
            32   30  33 1
            33   31  34 2
            34   33  35 1
            35   33  36 2
            36   34  37 1
            37   35  38 1
            38   38  39 1
            39   39  40 1
            40   39  41 2
            41   40  42 1
            42   42  43 1
            43   42  44 1 #Down
            44   43  45 1
            45   43  46 2
            46   45  47 1
            47   45  48 1
            48   47  49 1
            49   47  50 1 #Down
            50   48  51 1
            51   50  52 1
            52   50  53 2
            53   22  23 1
            54   32  34 1
            55   49  51 1
            56    1  54 1 #Up
            57   54  55 1
            58   55  56 1
            59   56  58 2
            60   56  59 1
            61   57  60 1
            62   58  61 1
            63   59  62 2
            64   61  63 2
            65   58  60 1
            66   62  63 1
            67   57  55 2
            68    7  64 1 #Down
            69   64  65 1
            70   65  66 2
            71   66  67 1
            72   67  68 2
            73   68  69 1
            74   69  65 1
            75    9  70 1 #Down
            76   70  71 1
            77   30  72 1 #Down
            78   72  73 1
            79   73  74 1
            80   73  75 1
            81   38  76 1 #Up
            82   76  77 1
            83   77  78 1
            84   77  79 1
            85   52  80 1
            86   80  81 1
            87   44  82 1
            88   82  83 1
            89   83  84 1
            90   84  85 1
            91   85  86 1
            92   85  87 2
            93   88  89 1
            94   88  90 1
            95   88  91 2
            96   88  92 2
BRACKET     1    33.7400  -23.4500   33.7400  -18.6900
            1    40.1100  -18.6900   40.1100  -23.4500
            1  x
 ORIGINAL  1   88  89  90  91  92
 REPEAT    1

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