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KEGG   COMPOUND: C06865
Entry
C06865                      Compound                               
Name
Calcitonin;
Cibacalcin
Formula
C145H240N44O48S2
Exact mass
3429.7133
Mol weight
3431.86
Structure
Sequence
Cys Ser Asn Leu Ser Thr Cys Val Leu Gly Lys Leu Ser Gln Glu Leu
His Lys Leu Gln Thr Tyr Pro Arg Thr Asn Thr Gly Ser Gly Thr
Pro-NH2 (Disulfide bridge: 1-7)
  Organism
Salmo salar [SASA:106562334]
  Type
Peptide
Pathway
map04080  Neuroactive ligand-receptor interaction
Brite
Compounds with biological roles [BR:br08001]
 Hormones and transmitters
  Peptide hormones
   Calcitonin
    C06865  Calcitonin
Bioactive peptides [BR:br08005]
 Calcium-regulating peptides
  Thyroid peptide hormone
   C06865  Calcitonin
Other DBs
CAS: 9007-12-9
PubChem: 9082
ChEBI: 3306
NIKKAJI: J949K
KCF data

ATOM        239
            1   N1y N    40.6510  -22.0314
            2   C1y C    41.7828  -22.8442
            3   C5a C    40.6510  -20.6424
            4   C1x C    39.5395  -22.8442
            5   C5a C    42.9352  -22.0932
            6   C1x C    41.3403  -24.1718
            7   C1c C    39.4574  -19.9426
            8   O5a O    41.8652  -19.9426
            9   C1x C    39.9512  -24.1718
            10  N1b N    44.1595  -22.7517
            11  O5a O    42.9229  -20.7143
            12  C1b C    39.4780  -18.0699
            13  N1b N    38.2534  -20.6424
            14  C1c C    45.2195  -22.0624
            15  C8y C    38.3870  -17.3600
            16  C5a C    37.0392  -19.9426
            17  C5a C    46.2895  -22.6900
            18  C1b C    45.2502  -20.6218
            19  C8x C    37.1729  -18.0803
            20  C8x C    38.3769  -15.9399
            21  C1c C    35.8250  -20.6424
            22  O5a O    37.0598  -18.8827
            23  N1b N    46.2895  -24.0378
            24  O5a O    47.2053  -22.1344
            25  C1b C    44.2295  -20.0148
            26  C8x C    35.9384  -17.3806
            27  C8x C    37.1320  -15.2506
            28  N1b N    34.6520  -19.9426
            29  C1c C    35.8354  -22.0314
            30  C1c C    45.5796  -24.8405
            31  C1b C    44.2213  -18.7595
            32  C8y C    35.9178  -15.9710
            33  C5a C    33.4378  -20.6424
            34  C1a C    34.6520  -22.7910
            35  O1a O    37.0392  -22.7210
            36  C5a C    45.5692  -27.7627
            37  C1c C    44.2318  -24.8611
            38  N1b N    42.8858  -18.1111
            39  O1a O    34.6932  -15.2611
            40  C1c C    32.2236  -19.9426
            41  O5a O    33.4378  -21.8214
            42  N1b N    44.3860  -28.4625
            43  O5a O    46.7834  -28.4625
            44  C1a C    43.8776  -25.7500
            45  O1a O    43.5114  -23.6365
            46  C2c C    42.9042  -16.7014
            47  N1b N    31.0095  -20.6424
            48  C1b C    32.2236  -18.5536
            49  C1c C    43.1719  -27.7732
            50  N1a N    44.0876  -15.9298
            51  N2a N    41.6282  -16.0533
            52  C5a C    29.8263  -19.9426
            53  C1b C    31.0095  -17.8437
            54  C5a C    41.9577  -28.4932
            55  C1b C    43.1614  -26.6103
            56  C1c C    28.6121  -20.6424
            57  O5a O    29.8263  -18.5536
            58  C5a C    31.0095  -16.4648
            59  N1b N    40.7435  -27.8039
            60  O5a O    41.9083  -29.7920
            61  C5a C    41.6799  -26.2400
            62  N1b N    27.4081  -19.9426
            63  C1b C    28.6121  -22.0314
            64  N1a N    29.8263  -15.7549
            65  O5a O    32.2236  -15.7549
            66  C1c C    39.5600  -28.5037
            67  N1a N    41.5357  -24.9597
            68  O5a O    39.9842  -25.9622
            69  C5a C    26.2044  -20.6424
            70  C1c C    29.8263  -22.7210
            71  C5a C    38.3459  -27.8141
            72  C1c C    39.5705  -29.9028
            73  C1c C    24.9902  -19.9426
            74  O5a O    26.2044  -22.0314
            75  C1a C    29.8263  -24.0996
            76  C1a C    31.0095  -22.0314
            77  N1b N    37.1421  -28.5138
            78  O5a O    38.3357  -26.4250
            79  C1a C    38.3769  -30.5924
            80  O1a O    40.7948  -30.7014
            81  N1b N    23.7966  -20.6424
            82  C1b C    24.9902  -18.5536
            83  C1b C    35.9485  -27.8245
            84  C5a C    22.6030  -19.9426
            85  C1b C    23.7966  -17.8437
            86  C5a C    34.7448  -28.5138
            87  C1c C    21.3888  -20.6424
            88  O5a O    22.6030  -18.5536
            89  C1b C    23.7966  -16.4648
            90  N1b N    33.5306  -27.8451
            91  O5a O    34.7550  -29.9339
            92  C1b C    21.3888  -22.0314
            93  N1b N    20.1952  -19.9426
            94  C1b C    22.6030  -15.7549
            95  C1c C    32.3472  -28.5550
            96  C8y C    22.6030  -22.7210
            97  C5a C    18.9811  -20.6424
            98  N1a N    22.6030  -14.3760
            99  C5a C    31.1229  -27.8552
            100 C1b C    32.3472  -29.9339
            101 C8x C    23.8584  -22.1651
            102 N4x N    22.7367  -24.0996
            103 C1c C    17.7976  -19.9426
            104 O5a O    18.9811  -22.0314
            105 N1b N    29.9188  -28.5654
            106 O5a O    31.1229  -26.4662
            107 O1a O    31.1434  -30.6438
            108 N5x N    24.7843  -23.2044
            109 C8x C    24.1051  -24.3879
            110 N1b N    16.5834  -20.6424
            111 C1b C    17.7976  -18.5536
            112 C1b C    28.7252  -27.8758
            113 C5a C    15.3693  -19.9426
            114 C1c C    18.9811  -17.8437
            115 C5a C    27.5215  -28.5654
            116 C1c C    15.3693  -18.5536
            117 O5a O    14.1551  -20.6424
            118 C1a C    18.9605  -16.7632
            119 C1a C    19.9482  -18.3271
            120 N1b N    26.3073  -27.8863
            121 O5a O    27.5316  -29.9646
            122 N1b N    14.1551  -17.8437
            123 C1b C    16.5834  -17.8437
            124 C1c C    25.1033  -28.5860
            125 C5a C    14.1551  -16.4648
            126 C1b C    16.6021  -16.1458
            127 C5a C    23.8995  -27.8964
            128 C1c C    25.1239  -29.9852
            129 C1c C    12.9719  -15.7549
            130 O5a O    15.3693  -15.7549
            131 C6a C    17.6022  -15.1477
            132 N1y N    22.6749  -28.6167
            133 O5a O    23.8995  -26.7174
            134 C1a C    23.9201  -30.6849
            135 O1a O    26.3279  -30.6748
            136 N1b N    12.9719  -14.3760
            137 C1b C    11.7679  -16.4648
            138 O6a O    17.2730  -13.7998
            139 O6a O    18.8062  -15.6003
            140 C1y C    21.5124  -27.7732
            141 C1x C    22.2223  -29.9646
            142 C5a C    11.7679  -13.6763
            143 C1b C    11.7679  -17.8437
            144 C1x C    20.3701  -28.6167
            145 C5a C    21.5124  -26.3633
            146 C1x C    20.8126  -29.9646
            147 C1c C    11.7679  -12.2872
            148 O5a O    10.5746  -14.3760
            149 C5a C    12.8382  -18.9857
            150 N1a N    22.7471  -25.6534
            151 O5a O    20.2982  -25.6534
            152 N1b N    12.9719  -11.5979
            153 C1b C    10.5746  -11.5979
            154 N1a N    11.9738  -20.2204
            155 O5a O    14.1243  -18.9467
            156 C5a C    12.9719  -10.2086
            157 O1a O    10.5746  -10.3486
            158 C1c C    14.1551   -9.4987
            159 O5a O    11.7679   -9.4987
            160 N1b N    15.3693  -10.2086
            161 C1b C    14.1551   -8.1097
            162 C5a C    16.5834   -9.4987
            163 C1c C    12.9719   -7.4305
            164 C1c C    16.5834   -8.1097
            165 O5a O    17.7976  -10.2086
            166 C1a C    11.7679   -8.1097
            167 C1a C    12.9719   -6.0415
            168 N1b N    17.7976   -7.4305
            169 C1b C    15.3693   -7.4305
            170 C5a C    18.9811   -8.1097
            171 C1b C    15.3693   -6.0415
            172 C1b C    20.1952   -7.4305
            173 O5a O    18.9811   -9.4987
            174 C1b C    14.1551   -5.3212
            175 N1b N    21.3888   -8.1097
            176 C1b C    14.1551   -3.9527
            177 C5a C    22.6030   -7.4305
            178 N1a N    12.9719   -3.2634
            179 C1c C    23.7966   -8.1097
            180 O5a O    22.6030   -6.0415
            181 N1b N    24.9902   -7.4305
            182 C1b C    23.7966   -9.4987
            183 C5a C    26.2044   -8.1097
            184 C1c C    22.6030  -10.2086
            185 C1c C    27.4081   -7.4305
            186 O5a O    26.2044   -9.4987
            187 C1a C    22.6030  -11.5979
            188 C1a C    21.3888   -9.4987
            189 N1b N    28.6121   -8.1097
            190 C1c C    27.4081   -6.0415
            191 C5a C    29.8263   -7.4305
            192 C1a C    28.6121   -5.3212
            193 C1a C    26.2044   -5.3212
            194 C1c C    31.0095   -8.1097
            195 O5a O    29.8263   -6.0415
            196 N1b N    32.2236   -7.4305
            197 C1b C    31.0405  -11.7728
            198 C5a C    33.4378   -8.1097
            199 S3a S    32.1517  -12.4827
            200 C1c C    34.6520   -7.4305
            201 O5a O    33.4378   -9.4987
            202 S3a S    33.3555  -11.6287
            203 N1b N    35.8354   -8.1097
            204 C1c C    34.6520   -6.0415
            205 C1b C    34.6314  -12.4209
            206 C5a C    37.0392   -7.4305
            207 C1a C    33.4378   -5.3212
            208 O1a O    35.8354   -5.3212
            209 C1c C    35.7737  -11.6287
            210 C1c C    38.2534   -8.1097
            211 O5a O    37.0392   -6.0415
            212 C5a C    37.0084  -12.4209
            213 N1a N    35.7426  -10.2498
            214 N1b N    39.4574   -7.4305
            215 C1b C    38.2040   -9.2519
            216 N1b N    38.3151  -11.7212
            217 O5a O    37.0290  -13.3471
            218 C5a C    40.6510   -8.1097
            219 O1a O    37.1523   -9.5317
            220 C1c C    39.5395  -12.5239
            221 C1c C    41.8652   -7.4305
            222 O5a O    40.6510   -9.4987
            223 C5a C    40.7229  -11.7728
            224 C1b C    39.5480  -13.9851
            225 N1b N    43.0793   -8.1097
            226 C1b C    41.8652   -6.0415
            227 N1b N    42.0090  -12.4827
            228 O5a O    40.7210  -10.4867
            229 O1a O    40.7435  -14.7568
            230 C5a C    43.6556  -10.0543
            231 C1c C    43.0793   -5.3212
            232 C1c C    43.1614  -11.7728
            233 O5a O    44.7399  -10.0543
            234 C1a C    43.0793   -3.9527
            235 C1a C    44.2729   -6.0415
            236 C1b C    44.2318  -12.4621
            237 C5a C    45.5384  -11.7212
            238 N1a N    46.4954  -12.3592
            239 O5a O    45.6002  -10.7499
BOND        243
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     5  10 1
            10    5  11 2
            11    7  12 1
            12    7  13 1
            13   10  14 1
            14   12  15 1
            15   13  16 1
            16   14  17 1
            17   14  18 1
            18   15  19 1
            19   15  20 2
            20   16  21 1
            21   16  22 2
            22   17  23 1
            23   17  24 2
            24   18  25 1
            25   19  26 2
            26   20  27 1
            27   21  28 1
            28   21  29 1
            29   23  30 1
            30   25  31 1
            31   26  32 1
            32   28  33 1
            33   29  34 1
            34   29  35 1
            35   30  36 1
            36   30  37 1
            37   31  38 1
            38   32  39 1
            39   33  40 1
            40   33  41 2
            41   36  42 1
            42   36  43 2
            43   37  44 1
            44   37  45 1
            45   38  46 1
            46   40  47 1
            47   40  48 1
            48   42  49 1
            49   46  50 1
            50   46  51 2
            51   47  52 1
            52   48  53 1
            53   49  54 1
            54   49  55 1
            55   52  56 1
            56   52  57 2
            57   53  58 1
            58   54  59 1
            59   54  60 2
            60   55  61 1
            61   56  62 1
            62   56  63 1
            63   58  64 1
            64   58  65 2
            65   59  66 1
            66   61  67 1
            67   61  68 2
            68   62  69 1
            69   63  70 1
            70   66  71 1
            71   66  72 1
            72   69  73 1
            73   69  74 2
            74   70  75 1
            75   70  76 1
            76   71  77 1
            77   71  78 2
            78   72  79 1
            79   72  80 1
            80   73  81 1
            81   73  82 1
            82   77  83 1
            83   81  84 1
            84   82  85 1
            85   83  86 1
            86   84  87 1
            87   84  88 2
            88   85  89 1
            89   86  90 1
            90   86  91 2
            91   87  92 1
            92   87  93 1
            93   89  94 1
            94   90  95 1
            95   92  96 1
            96   93  97 1
            97   94  98 1
            98   95  99 1
            99   95 100 1
            100  96 101 2
            101  96 102 1
            102  97 103 1
            103  97 104 2
            104  99 105 1
            105  99 106 2
            106 100 107 1
            107 101 108 1
            108 102 109 1
            109 103 110 1
            110 103 111 1
            111 105 112 1
            112 110 113 1
            113 111 114 1
            114 112 115 1
            115 113 116 1
            116 113 117 2
            117 114 118 1
            118 114 119 1
            119 115 120 1
            120 115 121 2
            121 116 122 1
            122 116 123 1
            123 120 124 1
            124 122 125 1
            125 123 126 1
            126 124 127 1
            127 124 128 1
            128 125 129 1
            129 125 130 2
            130 126 131 1
            131 127 132 1
            132 127 133 2
            133 128 134 1
            134 128 135 1
            135 129 136 1
            136 129 137 1
            137 131 138 1
            138 131 139 2
            139 132 140 1
            140 132 141 1
            141 136 142 1
            142 137 143 1
            143 140 144 1
            144 140 145 1
            145 141 146 1
            146 142 147 1
            147 142 148 2
            148 143 149 1
            149 145 150 1
            150 145 151 2
            151 147 152 1
            152 147 153 1
            153 149 154 1
            154 149 155 2
            155 152 156 1
            156 153 157 1
            157 156 158 1
            158 156 159 2
            159 158 160 1
            160 158 161 1
            161 160 162 1
            162 161 163 1
            163 162 164 1
            164 162 165 2
            165 163 166 1
            166 163 167 1
            167 164 168 1
            168 164 169 1
            169 168 170 1
            170 169 171 1
            171 170 172 1
            172 170 173 2
            173 171 174 1
            174 172 175 1
            175 174 176 1
            176 175 177 1
            177 176 178 1
            178 177 179 1
            179 177 180 2
            180 179 181 1
            181 179 182 1
            182 181 183 1
            183 182 184 1
            184 183 185 1
            185 183 186 2
            186 184 187 1
            187 184 188 1
            188 185 189 1
            189 185 190 1
            190 189 191 1
            191 190 192 1
            192 190 193 1
            193 191 194 1
            194 191 195 2
            195 194 196 1
            196 194 197 1
            197 196 198 1
            198 197 199 1
            199 198 200 1
            200 198 201 2
            201 199 202 1
            202 200 203 1
            203 200 204 1
            204 202 205 1
            205 203 206 1
            206 204 207 1
            207 204 208 1
            208 205 209 1
            209 206 210 1
            210 206 211 2
            211 209 212 1
            212 209 213 1
            213 210 214 1
            214 210 215 1
            215 212 216 1
            216 212 217 2
            217 214 218 1
            218 215 219 1
            219 216 220 1
            220 218 221 1
            221 218 222 2
            222 220 223 1
            223 220 224 1
            224 221 225 1
            225 221 226 1
            226 223 227 1
            227 223 228 2
            228 224 229 1
            229 225 230 1
            230 226 231 1
            231 227 232 1
            232 230 233 2
            233 231 234 1
            234 231 235 1
            235 232 236 1
            236 236 237 1
            237 237 238 1
            238 237 239 2
            239   6   9 1
            240  27  32 2
            241 108 109 2
            242 144 146 1
            243 230 232 1

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