KEGG   COMPOUND: C15927
Entry
C15927                      Compound                               
Name
Leucokinin I
Formula
C41H53N11O12
Exact mass
891.3875
Mol weight
891.926
Structure
Sequence
Asp Pro Ala Phe Asn Ser Trp Gly-NH2
  Organism
Rhyparobia maderae [UP:LCK1_RHYMA]
  Type
Peptide
Other DBs
CAS: 104600-89-7
PubChem: 47205245
ChEBI: 80183
NIKKAJI: J562.383I
LinkDB
KCF data

ATOM        64
            1   C8y C    22.8173  -25.9271
            2   C1b C    24.0834  -26.6305
            3   C1c C    25.2792  -25.9271
            4   N1b N    26.4749  -26.6305
            5   C5a C    27.7410  -25.9271
            6   C1c C    28.9367  -26.6305
            7   N1b N    30.1325  -25.9271
            8   C5a C    31.3986  -26.6305
            9   C1c C    32.5943  -25.9271
            10  N1b N    33.7901  -26.6305
            11  C5a C    35.0562  -25.9271
            12  C1c C    36.2519  -26.6305
            13  N1b N    37.4477  -25.9271
            14  C5a C    38.6434  -26.6305
            15  C1c C    39.9095  -25.9271
            16  N1b N    41.1053  -26.6305
            17  C5a C    42.3010  -25.9271
            18  C1y C    43.5671  -26.6305
            19  C5a C    25.2792  -24.5203
            20  N1b N    26.4749  -23.8169
            21  O5a O    24.0834  -23.8169
            22  C1b C    26.4749  -22.4102
            23  C5a C    27.6707  -21.7068
            24  O5a O    28.8664  -22.4102
            25  N1a N    27.6707  -20.3000
            26  O5a O    27.7410  -24.5203
            27  C1b C    28.9367  -28.0372
            28  O1a O    30.1325  -28.7406
            29  O5a O    31.3986  -28.0372
            30  O5a O    35.0562  -24.7313
            31  C1b C    36.2519  -28.0372
            32  O5a O    38.6434  -28.0372
            33  C1a C    39.9095  -24.5203
            34  O5a O    42.3010  -24.5203
            35  C1x C    43.7372  -28.0269
            36  C1x C    45.1179  -28.2967
            37  C1x C    45.8010  -27.0669
            38  N1y N    44.8426  -26.0371
            39  C5a C    44.8426  -24.6303
            40  C1c C    46.0406  -23.9391
            41  O5a O    43.6308  -23.9307
            42  C1b C    47.2579  -24.6423
            43  N1a N    46.0409  -22.5509
            44  C6a C    48.4434  -23.9583
            45  O6a O    49.6439  -24.6520
            46  O6a O    48.4439  -22.5510
            47  C8y C    35.0337  -28.7406
            48  C8x C    33.8324  -28.0469
            49  C8x C    32.6140  -28.7502
            50  C8x C    32.6138  -30.1569
            51  C8x C    33.8151  -30.8507
            52  C8x C    35.0335  -30.1474
            53  C1b C    32.5943  -24.5203
            54  C5a C    31.3761  -23.8169
            55  N1a N    30.1748  -24.5107
            56  O5a O    31.3760  -22.4104
            57  C8x C    22.6447  -24.5110
            58  N4x N    21.2446  -24.2376
            59  C8y C    20.5519  -25.4847
            60  C8y C    21.5239  -26.5288
            61  C8x C    19.1875  -25.7984
            62  C8x C    18.7770  -27.1369
            63  C8x C    19.7490  -28.1811
            64  C8x C    21.1134  -27.8673
BOND        67
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12   12  13 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 1
            17   18  17 1 #Up
            18    3  19 1 #Up
            19   19  20 1
            20   19  21 2
            21   20  22 1
            22   22  23 1
            23   23  24 2
            24   23  25 1
            25    5  26 2
            26    6  27 1 #Up
            27   27  28 1
            28    8  29 2
            29   11  30 2
            30   12  31 1 #Up
            31   14  32 2
            32   15  33 1 #Down
            33   17  34 2
            34   18  35 1
            35   35  36 1
            36   36  37 1
            37   37  38 1
            38   18  38 1
            39   38  39 1
            40   39  40 1
            41   39  41 2
            42   40  42 1
            43   40  43 1 #Up
            44   42  44 1
            45   44  45 1
            46   44  46 2
            47   31  47 1
            48   47  48 2
            49   48  49 1
            50   49  50 2
            51   50  51 1
            52   51  52 2
            53   47  52 1
            54    9  53 1 #Down
            55   53  54 1
            56   54  55 1
            57   54  56 2
            58    1  57 2
            59   57  58 1
            60   58  59 1
            61   59  60 1
            62    1  60 1
            63   59  61 2
            64   61  62 1
            65   62  63 2
            66   63  64 1
            67   60  64 2

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