KEGG   DRUG: D00989Help
Entry
D00989                      Drug                                   

Name
Leuprorelin acetate (JP16);
Leuprolide acetate (USAN);
Lupron (TN);
Lutrate (TN)
Product
  Generic
Formula
C59H84N16O12. C2H4O2
Exact mass
1268.6666
Mol weight
1269.4502
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antineoplastic;
LHRH agonist [DS:H00024]
Remark
Therapeutic category: 
ATC code: 
Drug group: 
Comment
Leuprorelin cause downregulation of gonadotropin-releasing hormone (GnRH) receptor.
Target
gonadotropin-releasing hormone (GnRH) receptor agonist [HSA:2798] [KO:K04280]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04912  GnRH signaling pathway  
 
Interaction
Drug interaction
Structure map
Antineoplastics - hormones
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
      D00989  Leuprorelin acetate (JAN); Leuprolide acetate (USAN)
USP drug classification [BR:br08302]
 Hormonal Agents, Suppressant (Pituitary)
  Leuprolide
   D00989  Leuprorelin acetate (JAN); Leuprolide acetate (USAN)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  24  Hormones
   249  Miscellaneous
    2499  Others
     D00989  Leuprorelin acetate (JP16); Leuprolide acetate (USAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Gonadotropin-releasing hormone
    gonadotropin-releasing hormone (GnRH) receptor
     Leuprorelin
      D00989  Leuprorelin acetate (JAN); Leuprolide acetate (USAN)
Antineoplastics [BR:br08308]
 Hormones and hormone antagonist
  Lutenizing hormone-releasing hormone agonist
   Leuprorelin
    D00989  Leuprorelin acetate (JAN); Leuprolide acetate (USAN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00989  Leuprorelin acetate
BRITE hierarchy
Other DBs
CAS: 
74381-53-6
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        91
            1   C6a C    17.2659  -15.4940
            2   C1a C    16.0590  -16.1931
            3   O6a O    18.4631  -16.1834
            4   O6a O    17.2562  -14.1051
            5   C8y C    14.3385   -7.1743
            6   C8y C    14.7429   -5.8670
            7   C1b C    13.1629   -7.8703
            8   C8x C    15.4578   -7.9643
            9   C8y C    16.1067   -5.8482
            10  C8x C    14.0469   -4.6915
            11  C1c C    13.1818   -9.5965
            12  N4x N    16.5487   -7.1366
            13  C8x C    16.7743   -4.6631
            14  C8x C    14.7148   -3.4971
            15  N1b N    12.0062  -10.2830
            16  C5a C    14.3761  -10.2454
            17  C8x C    16.0878   -3.4876
            18  C5a C    10.8116   -9.6153
            19  N1b N    15.5516   -9.5495
            20  O5a O    14.3169  -11.6091
            21  C1c C     9.6361  -10.3018
            22  O5a O    10.7822   -8.2423
            23  C1c C    16.7366  -10.2077
            24  C1b C     9.6561  -12.5749
            25  N1b N     8.4417   -9.6437
            26  C5a C    17.9217   -9.5212
            27  C1b C    16.7555  -11.5902
            28  C8y C    10.9193  -13.2614
            29  C5a C     7.2659  -10.3394
            30  N1b N    19.1257  -10.1984
            31  O5a O    17.9030   -8.1386
            32  O1a O    17.9501  -12.2582
            33  C1y C     6.0716   -9.6718
            34  O5a O     7.2848  -11.7126
            35  C1c C    20.3011   -9.4931
            36  C1x C     4.8301  -10.2360
            37  N1x N     5.9118   -8.3080
            38  C1b C    20.3107   -8.1294
            39  C5a C    21.5051  -10.1704
            40  C1x C     3.8990   -9.2392
            41  C5x C     4.5950   -8.0446
            42  C8y C    21.4175   -7.4145
            43  N1b N    22.6994   -9.4836
            44  O5a O    21.5238  -11.5621
            45  O5x O     4.0026   -6.8033
            46  C8x C    22.6994   -8.0918
            47  C8x C    21.4486   -6.0415
            48  C1c C    23.9129  -10.1704
            49  C8x C    23.8857   -7.3864
            50  C8x C    22.6432   -5.3455
            51  C5a C    25.1072   -9.4647
            52  C1b C    23.9221  -12.4963
            53  C8y C    23.8564   -6.0132
            54  N1b N    26.3110  -10.1515
            55  O5a O    25.1570   -8.0918
            56  O1a O    25.0319   -5.3079
            57  C1c C    27.4773   -9.4459
            58  C5a C    28.6620  -10.1231
            59  C1b C    27.5285   -7.6698
            60  N1b N    29.8660   -9.4366
            61  O5a O    28.6217  -11.5152
            62  C1c C    28.6340   -6.9741
            63  C1c C    31.0698  -10.1231
            64  C1a C    28.6340   -5.6008
            65  C1a C    29.8379   -7.6606
            66  C5a C    32.2642   -9.4082
            67  C1b C    31.0698  -11.4964
            68  N1y N    33.4681  -10.0762
            69  O5a O    32.2642   -8.0257
            70  C1b C    29.8848  -12.1733
            71  C1y C    34.8318  -10.0762
            72  C1x C    33.0448  -11.3834
            73  C1b C    29.8848  -13.5466
            74  C1x C    35.2551  -11.3834
            75  C5a C    36.1298   -9.3709
            76  C1x C    34.1453  -12.1828
            77  N1b N    28.6997  -14.2331
            78  N1b N    37.3805  -10.1420
            79  O5a O    36.0879   -7.8942
            80  C2c C    27.5242  -13.5466
            81  C1b C    37.3618  -11.6091
            82  N1a N    27.5150  -12.1828
            83  N2a N    26.3487  -14.2427
            84  C1a C    38.5330  -12.3157
            85  C1c C    22.7338  -13.1942
            86  C1a C    21.5527  -12.5244
            87  C1a C    22.7445  -14.6014
            88  C8x C    11.0975  -14.6187
            89  N5x N    12.4435  -14.8686
            90  C8x C    13.0971  -13.6658
            91  N4x N    12.1551  -12.6724
BOND        95
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     5   6 1
            5     5   7 1
            6     5   8 2
            7     6   9 2
            8     6  10 1
            9     7  11 1
            10    8  12 1
            11    9  13 1
            12   10  14 2
            13   11  15 1
            14   11  16 1
            15   13  17 2
            16   15  18 1
            17   16  19 1
            18   16  20 2
            19   18  21 1
            20   18  22 2
            21   19  23 1
            22   21  24 1
            23   21  25 1
            24   23  26 1
            25   23  27 1
            26   24  28 1
            27   25  29 1
            28   26  30 1
            29   26  31 2
            30   27  32 1
            31   29  33 1
            32   29  34 2
            33   30  35 1
            34   33  36 1
            35   33  37 1
            36   35  38 1
            37   35  39 1
            38   36  40 1
            39   37  41 1
            40   38  42 1
            41   39  43 1
            42   39  44 2
            43   41  45 2
            44   42  46 2
            45   42  47 1
            46   43  48 1
            47   46  49 1
            48   47  50 2
            49   48  51 1
            50   48  52 1
            51   49  53 2
            52   51  54 1
            53   51  55 2
            54   53  56 1
            55   54  57 1
            56   57  58 1
            57   57  59 1
            58   58  60 1
            59   58  61 2
            60   59  62 1
            61   60  63 1
            62   62  64 1
            63   62  65 1
            64   63  66 1
            65   63  67 1
            66   66  68 1
            67   66  69 2
            68   67  70 1
            69   68  71 1
            70   68  72 1
            71   70  73 1
            72   71  74 1
            73   71  75 1
            74   72  76 1
            75   73  77 1
            76   75  78 1
            77   75  79 2
            78   77  80 1
            79   78  81 1
            80   80  82 1
            81   80  83 2
            82    9  12 1
            83   14  17 1
            84   40  41 1
            85   50  53 1
            86   74  76 1
            87   81  84 1
            88   52  85 1
            89   85  86 1
            90   85  87 1
            91   28  88 2
            92   88  89 1
            93   89  90 2
            94   90  91 1
            95   28  91 1

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