KEGG   DRUG: Sermorelin
Entry
D08509                      Drug                                   
Name
Sermorelin (INN);
Geref (TN)
Formula
C149H246N44O42S
Exact mass
3355.8187
Mol weight
3357.8821
Structure
Simcomp
Sequence
Tyr Ala Asp Ala Ile Phe Thr Asn Ser Tyr Arg Lys Val Leu Gly Gln
Leu Ser Ala Arg Lys Leu Leu Gln Asp Ile Met Ser Arg
  Type
Peptide
Remark
ATC code: H01AC04 V04CD03
Chemical structure group: DG00494
Efficacy
Diagnostic (pituitary function determination), Growth hormone releasing hormone receptor agonist
Comment
Growth hormone releasing hormone (GH-RH) analog
Target
GHRHR [HSA:2692] [KO:K04584]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
  H01 PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
   H01A ANTERIOR PITUITARY LOBE HORMONES AND ANALOGUES
    H01AC Somatropin and somatropin agonists
     H01AC04 Sermorelin
      D08509  Sermorelin (INN)
 V VARIOUS
  V04 DIAGNOSTIC AGENTS
   V04C OTHER DIAGNOSTIC AGENTS
    V04CD Tests for pituitary function
     V04CD03 Sermorelin
      D08509  Sermorelin (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Secretin receptor family
   Growth hormone-releasing hormone
    GHRHR
     D08509  Sermorelin (INN)
Other DBs
CAS: 86168-78-7
PubChem: 96025194
ChEBI: 9118
KCF data

ATOM        236
            1   C1c C    27.5779  -10.7092
            2   C1b C    27.5779  -12.0390
            3   N1b N    26.3880   -9.9392
            4   C5a C    28.8378   -9.9392
            5   C8y C    28.8378  -12.7390
            6   C5a C    25.1981  -10.7092
            7   N1b N    30.0277  -10.6392
            8   O5a O    28.8378   -8.6093
            9   C8x C    28.8378  -14.1389
            10  C8x C    30.0277  -12.0390
            11  C1c C    23.9382  -10.0092
            12  O5a O    25.1981  -12.0390
            13  C1c C    31.2176   -9.9392
            14  C8x C    30.0277  -14.8388
            15  C8x C    31.2176  -12.7390
            16  N1b N    22.7483  -10.7092
            17  C1c C    23.9382   -8.6093
            18  C5a C    32.4075  -10.6392
            19  C1c C    31.2176   -8.5393
            20  C8x C    31.2176  -14.1389
            21  C5a C    21.5584  -10.0092
            22  C1b C    25.2681   -7.9094
            23  C1a C    22.8183   -7.9094
            24  N1b N    33.6674   -9.9392
            25  O5a O    32.4075  -12.0390
            26  C1a C    32.4075   -7.9094
            27  O1a O    30.0277   -7.9094
            28  C1c C    20.3685  -10.7092
            29  O5a O    21.5584   -8.6093
            30  C1a C    25.2681   -6.5095
            31  C1c C    34.8573  -10.6392
            32  N1b N    19.1086  -10.0092
            33  C1a C    20.3685  -12.0390
            34  C5a C    36.0472   -9.9392
            35  C1b C    34.8573  -12.0390
            36  C5a C    17.9187  -10.7092
            37  N1b N    37.3071  -10.6392
            38  O5a O    36.0472   -8.5393
            39  C5a C    36.1172  -12.7390
            40  C1c C    16.7288  -10.0092
            41  O5a O    17.9187  -12.1090
            42  C1c C    38.4970   -9.9392
            43  N1a N    36.1172  -14.0689
            44  O5a O    37.3071  -12.0390
            45  N1b N    15.4689  -10.7092
            46  C1b C    16.7288   -8.6093
            47  C5a C    39.6869  -10.6392
            48  C1b C    38.4970   -8.5393
            49  C5a C    14.2790  -10.0092
            50  C6a C    17.9187   -7.9094
            51  N1b N    40.8768   -9.9392
            52  O5a O    39.6869  -12.0390
            53  O1a O    39.6869   -7.9094
            54  C1c C    13.0891  -10.7092
            55  O5a O    14.2790   -8.6093
            56  O6a O    19.1086   -8.6093
            57  O6a O    17.9187   -6.5095
            58  C1c C    42.1367  -10.6392
            59  N1b N    11.8992  -10.0092
            60  C1a C    13.0891  -12.1090
            61  C1b C    43.3266   -9.9392
            62  C5a C    42.1367  -12.0390
            63  C5a C    10.6393  -10.7092
            64  C8y C    43.3266   -8.5393
            65  N1b N    43.3266  -12.6690
            66  O5a O    40.8768  -12.6690
            67  C1c C     9.4494  -10.0092
            68  O5a O    10.6393  -12.1090
            69  C8x C    44.5165   -7.8394
            70  C8x C    42.1367   -7.8394
            71  C1c C    43.3266  -14.9088
            72  C1b C     9.4494   -8.6793
            73  N1a N     8.2595  -10.7092
            74  C8x C    44.5165   -6.4395
            75  C8x C    42.1367   -6.5095
            76  C5a C    42.1367  -15.6087
            77  C1b C    44.5165  -15.6087
            78  C8y C    10.6393   -7.9794
            79  C8y C    43.3266   -5.7396
            80  N1b N    42.1367  -17.0086
            81  O5a O    40.8768  -14.9088
            82  C1b C    44.5165  -17.0086
            83  C8x C    11.8992   -8.6093
            84  C8x C    10.6393   -6.5795
            85  O1a O    43.3266   -4.4097
            86  C1c C    40.8768  -17.7086
            87  C1b C    45.7764  -17.7086
            88  C8x C    13.0891   -7.9094
            89  C8x C    11.8292   -5.8795
            90  C5a C    39.6869  -17.0086
            91  C1b C    40.8768  -19.1085
            92  N1b N    45.7764  -19.0385
            93  C8y C    13.0891   -6.5795
            94  N1b N    38.4970  -17.7086
            95  O5a O    39.6869  -15.6087
            96  C1b C    42.1367  -19.7384
            97  C2c C    44.5165  -19.7384
            98  O1a O    14.2790   -5.8795
            99  C1c C    37.2371  -17.0086
            100 C1b C    42.1367  -21.1383
            101 N1a N    44.5165  -21.1383
            102 N2a N    43.3266  -19.0385
            103 C5a C    36.0472  -17.6386
            104 C1c C    37.2371  -15.6087
            105 C1b C    43.3266  -21.8382
            106 N1b N    34.8573  -16.9386
            107 O5a O    36.0472  -19.0385
            108 C1a C    38.4270  -14.9088
            109 C1a C    35.9772  -14.9088
            110 N1a N    43.3266  -23.2381
            111 C1c C    33.5974  -17.6386
            112 C5a C    32.4075  -16.9386
            113 C1b C    33.5974  -19.0385
            114 N1b N    31.2176  -17.6386
            115 O5a O    32.4075  -15.5388
            116 C1c C    32.4075  -19.7384
            117 C1b C    29.9577  -16.9386
            118 C1a C    31.1476  -19.0385
            119 C1a C    32.4075  -21.0683
            120 C5a C    28.7678  -17.5686
            121 N1b N    27.5779  -16.8686
            122 O5a O    28.7678  -18.9685
            123 C1c C    26.3180  -17.5686
            124 C5a C    25.1281  -16.8686
            125 C1b C    26.3180  -18.9685
            126 N1b N    23.9382  -17.5686
            127 O5a O    25.1281  -15.4688
            128 C1b C    25.1281  -19.6684
            129 C1c C    22.7483  -16.8686
            130 C5a C    25.1281  -21.0683
            131 C5a C    21.4884  -17.5686
            132 C1b C    22.7483  -15.4688
            133 N1a N    26.3180  -21.6982
            134 O5a O    23.9382  -21.6982
            135 N1b N    20.2985  -16.8686
            136 O5a O    21.4884  -18.9685
            137 C1c C    21.4884  -14.8388
            138 C1c C    19.1086  -17.5686
            139 C1a C    21.4884  -13.4389
            140 C1a C    20.2985  -15.4688
            141 C5a C    17.8487  -16.8686
            142 C1b C    19.1086  -18.9685
            143 N1b N    16.6588  -17.5686
            144 O5a O    17.8487  -15.4688
            145 O1a O    17.8487  -19.6684
            146 C1c C    15.4689  -16.8686
            147 C5a C    14.2090  -17.5686
            148 C1a C    15.4689  -15.4688
            149 N1b N    13.0191  -16.8686
            150 O5a O    14.2090  -18.9685
            151 C1c C    11.8292  -17.5686
            152 C5a C    11.8292  -18.9685
            153 C1b C    10.6393  -16.8686
            154 N1b N    10.5693  -19.6684
            155 O5a O    13.0191  -19.6684
            156 C1b C    10.6393  -15.4688
            157 C1c C    10.5693  -21.0683
            158 C1b C     9.3794  -14.8388
            159 C5a C     9.3794  -21.6982
            160 C1b C    11.8292  -21.6982
            161 N1b N     8.1895  -15.4688
            162 N1b N     9.3794  -23.0981
            163 O5a O     8.1895  -21.0683
            164 C1b C    13.0191  -21.0683
            165 C2c C     8.1895  -16.8686
            166 C1c C    10.5693  -23.7981
            167 C1b C    14.2090  -21.6982
            168 N1a N     6.9296  -17.5686
            169 N2a N     9.3794  -17.5686
            170 C5a C    10.5693  -25.1980
            171 C1b C    11.8292  -23.0981
            172 C1b C    15.4689  -20.9983
            173 N1b N    11.7592  -25.8979
            174 O5a O     9.3794  -25.8979
            175 C1c C    13.0191  -23.7981
            176 N1a N    16.6588  -21.6982
            177 C1c C    11.7592  -27.2978
            178 C1a C    13.0191  -25.1980
            179 C1a C    14.2090  -23.0981
            180 C5a C    13.0191  -27.9977
            181 C1b C    10.5693  -27.9977
            182 N1b N    14.2090  -27.2978
            183 O5a O    13.0191  -29.3976
            184 C1c C    10.5693  -29.3976
            185 C1c C    15.4689  -27.9977
            186 C1a C     9.3094  -30.0976
            187 C1a C    11.7592  -30.0976
            188 C5a C    16.6588  -27.2978
            189 C1b C    15.4689  -29.3976
            190 N1b N    17.9187  -27.9977
            191 O5a O    16.6588  -25.8979
            192 C1b C    16.6588  -30.0976
            193 C1c C    19.1086  -27.2978
            194 C5a C    16.6588  -31.5674
            195 C5a C    20.2985  -27.9977
            196 C1b C    19.1086  -25.8979
            197 N1a N    17.8487  -32.2674
            198 O5a O    15.3989  -32.1974
            199 N1b N    21.5584  -27.3678
            200 O5a O    20.2985  -29.4676
            201 C6a C    20.3685  -25.1980
            202 C1c C    22.8183  -28.0677
            203 O6a O    21.5584  -25.8979
            204 O6a O    20.3685  -23.7981
            205 C5a C    24.0082  -27.3678
            206 C1c C    22.8183  -29.4676
            207 N1b N    25.1981  -28.0677
            208 O5a O    24.0082  -25.9679
            209 C1b C    21.5584  -30.1675
            210 C1a C    24.0082  -30.1675
            211 C1c C    26.4580  -27.3678
            212 C1a C    21.5584  -31.5674
            213 C5a C    27.6479  -27.9977
            214 C1b C    26.4580  -25.9679
            215 N1b N    28.9078  -27.2978
            216 O5a O    27.6479  -29.4676
            217 C1b C    27.6479  -25.1980
            218 C1c C    30.0977  -27.9977
            219 S2a S    27.6479  -23.7981
            220 C5a C    31.2876  -27.2978
            221 C1b C    30.0977  -29.3976
            222 C1a C    28.8378  -23.0981
            223 N1b N    32.5475  -27.9977
            224 O5a O    31.2876  -25.8979
            225 O1a O    28.8378  -30.1675
            226 C1c C    33.8074  -27.2978
            227 C1b C    33.8074  -25.8279
            228 C5a C    34.9973  -27.9277
            229 C1b C    35.0673  -25.1280
            230 N1a N    36.1872  -27.2278
            231 O5a O    34.9973  -29.3976
            232 C1b C    35.0673  -23.7281
            233 N1b N    36.3272  -23.0281
            234 C2c C    36.3272  -21.6283
            235 N1a N    37.5171  -20.8583
            236 N2a N    35.0673  -20.9283
BOND        238
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     4   8 2
            8     5   9 2
            9     5  10 1
            10    6  11 1
            11    6  12 2
            12    7  13 1
            13    9  14 1
            14   10  15 2
            15   11  16 1
            16   11  17 1
            17   13  18 1
            18   13  19 1
            19   14  20 2
            20   16  21 1
            21   17  22 1
            22   17  23 1
            23   18  24 1
            24   18  25 2
            25   19  26 1
            26   19  27 1
            27   21  28 1
            28   21  29 2
            29   22  30 1
            30   24  31 1
            31   28  32 1
            32   28  33 1
            33   31  34 1
            34   31  35 1
            35   32  36 1
            36   34  37 1
            37   34  38 2
            38   35  39 1
            39   36  40 1
            40   36  41 2
            41   37  42 1
            42   39  43 1
            43   39  44 2
            44   40  45 1
            45   40  46 1
            46   42  47 1
            47   42  48 1
            48   45  49 1
            49   46  50 1
            50   47  51 1
            51   47  52 2
            52   48  53 1
            53   49  54 1
            54   49  55 2
            55   50  56 1
            56   50  57 2
            57   51  58 1
            58   54  59 1
            59   54  60 1
            60   58  61 1
            61   58  62 1
            62   59  63 1
            63   61  64 1
            64   62  65 1
            65   62  66 2
            66   63  67 1
            67   63  68 2
            68   64  69 2
            69   64  70 1
            70   65  71 1
            71   67  72 1
            72   67  73 1
            73   69  74 1
            74   70  75 2
            75   71  76 1
            76   71  77 1
            77   72  78 1
            78   74  79 2
            79   76  80 1
            80   76  81 2
            81   77  82 1
            82   78  83 2
            83   78  84 1
            84   79  85 1
            85   80  86 1
            86   82  87 1
            87   83  88 1
            88   84  89 2
            89   86  90 1
            90   86  91 1
            91   87  92 1
            92   88  93 2
            93   90  94 1
            94   90  95 2
            95   91  96 1
            96   92  97 1
            97   93  98 1
            98   94  99 1
            99   96 100 1
            100  97 101 1
            101  97 102 2
            102  99 103 1
            103  99 104 1
            104 100 105 1
            105 103 106 1
            106 103 107 2
            107 104 108 1
            108 104 109 1
            109 105 110 1
            110 106 111 1
            111 111 112 1
            112 111 113 1
            113 112 114 1
            114 112 115 2
            115 113 116 1
            116 114 117 1
            117 116 118 1
            118 116 119 1
            119 117 120 1
            120 120 121 1
            121 120 122 2
            122 121 123 1
            123 123 124 1
            124 123 125 1
            125 124 126 1
            126 124 127 2
            127 125 128 1
            128 126 129 1
            129 128 130 1
            130 129 131 1
            131 129 132 1
            132 130 133 1
            133 130 134 2
            134 131 135 1
            135 131 136 2
            136 132 137 1
            137 135 138 1
            138 137 139 1
            139 137 140 1
            140 138 141 1
            141 138 142 1
            142 141 143 1
            143 141 144 2
            144 142 145 1
            145 143 146 1
            146 146 147 1
            147 146 148 1
            148 147 149 1
            149 147 150 2
            150 149 151 1
            151 151 152 1
            152 151 153 1
            153 152 154 1
            154 152 155 2
            155 153 156 1
            156 154 157 1
            157 156 158 1
            158 157 159 1
            159 157 160 1
            160 158 161 1
            161 159 162 1
            162 159 163 2
            163 160 164 1
            164 161 165 1
            165 162 166 1
            166 164 167 1
            167 165 168 1
            168 165 169 2
            169 166 170 1
            170 166 171 1
            171 167 172 1
            172 170 173 1
            173 170 174 2
            174 171 175 1
            175 172 176 1
            176 173 177 1
            177 175 178 1
            178 175 179 1
            179 177 180 1
            180 177 181 1
            181 180 182 1
            182 180 183 2
            183 181 184 1
            184 182 185 1
            185 184 186 1
            186 184 187 1
            187 185 188 1
            188 185 189 1
            189 188 190 1
            190 188 191 2
            191 189 192 1
            192 190 193 1
            193 192 194 1
            194 193 195 1
            195 193 196 1
            196 194 197 1
            197 194 198 2
            198 195 199 1
            199 195 200 2
            200 196 201 1
            201 199 202 1
            202 201 203 1
            203 201 204 2
            204 202 205 1
            205 202 206 1
            206 205 207 1
            207 205 208 2
            208 206 209 1
            209 206 210 1
            210 207 211 1
            211 209 212 1
            212 211 213 1
            213 211 214 1
            214 213 215 1
            215 213 216 2
            216 214 217 1
            217 215 218 1
            218 217 219 1
            219 218 220 1
            220 218 221 1
            221 219 222 1
            222 220 223 1
            223 220 224 2
            224 221 225 1
            225 223 226 1
            226 226 227 1
            227 226 228 1
            228 227 229 1
            229 228 230 1
            230 228 231 2
            231 229 232 1
            232 232 233 1
            233 233 234 1
            234 234 235 1
            235 234 236 2
            236  15  20 1
            237  75  79 1
            238  89  93 1

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