KEGG   COMPOUND: C06684Help
Entry
C06684                      Compound                               

Name
Valinomycin
Formula
C54H90N6O18
Exact mass
1110.6312
Mol weight
1111.3218
Structure
Mol fileKCF fileDB search
Brite
Compounds with biological roles [BR:br08001]
 Antibiotics
  Polyketides and nonribosomal peptides
   Non-ribosomal peptides
    C06684  Valinomycin
BRITE hierarchy
Other DBs
CAS: 2001-95-8
PubChem: 8909
ChEBI: 28545
ChEMBL: CHEMBL223643
NIKKAJI: J9.541I
KCF data Show

ATOM        78
            1   C1c C    18.4340  -14.6821
            2   C5a C    18.7536  -13.4227
            3   O7a O    19.4696  -16.0182
            4   C1c C    17.1682  -14.4967
            5   N1b N    20.3391  -12.8154
            6   O5a O    17.8586  -12.4702
            7   C7a C    18.4787  -17.2136
            8   C1a C    16.7016  -13.2885
            9   C1a C    16.3499  -15.5004
            10  C1c C    19.9874  -11.1788
            11  C1c C    18.8367  -18.4794
            12  O6a O    17.2258  -16.8365
            13  C7a C    20.9015  -10.2393
            14  C1c C    18.9965  -10.3798
            15  N1b N    20.2047  -18.9460
            16  C1c C    17.6413  -18.9460
            17  O7a O    22.4805  -10.1881
            18  O6a O    20.3135   -8.8455
            19  C1a C    19.1947   -9.0885
            20  C1a C    17.7692  -10.8401
            21  C5a C    20.1472  -20.6657
            22  C1a C    17.4431  -20.2119
            23  C1a C    16.6120  -18.1277
            24  C1c C    23.0878   -8.9287
            25  C1c C    21.1125  -21.5798
            26  O5a O    19.0221  -21.1451
            27  C5a C    24.3472   -8.5643
            28  C1a C    22.1353   -7.7141
            29  O7a O    22.6724  -21.2730
            30  C1a C    20.6715  -22.8903
            31  N1b N    25.5490   -9.6638
            32  O5a O    24.7500   -7.3112
            33  C7a C    23.3563  -22.8073
            34  C1c C    26.8786   -8.5131
            35  C1c C    24.5902  -23.1460
            36  O6a O    22.7682  -23.9324
            37  C7a C    28.1382   -8.8455
            38  C1c C    27.0768   -7.2602
            39  N1b N    25.7663  -22.1488
            40  C1c C    24.3983  -24.3990
            41  O7a O    28.8860  -10.3798
            42  O6a O    29.1035   -7.9123
            43  C1a C    26.0605   -6.4419
            44  C1a C    28.2724   -6.7871
            45  C5a C    27.1601  -23.0948
            46  C1a C    25.4083  -25.2173
            47  C1a C    23.1964  -24.8657
            48  C1c C    30.3819  -10.0793
            49  C1c C    28.3810  -22.7240
            50  O5a O    26.8786  -24.4758
            51  C5a C    31.3217  -10.9871
            52  C1c C    31.1937   -9.0630
            53  O7a O    29.0458  -21.2281
            54  C1c C    28.8541  -23.9387
            55  N1b N    31.4368  -12.7131
            56  O5a O    32.6131  -10.5077
            57  C1a C    30.7592   -7.8674
            58  C1a C    32.4724   -9.2802
            59  C7a C    30.5801  -21.4135
            60  C1a C    28.0358  -24.9487
            61  C1a C    30.1454  -24.1306
            62  C1c C    32.6385  -13.1734
            63  C1c C    31.4942  -20.4738
            64  O6a O    31.0467  -22.8392
            65  C7a C    33.0220  -14.4392
            66  C1c C    33.8724  -12.7131
            67  N1b N    31.5517  -18.7478
            68  C1c C    32.4979  -21.2730
            69  O7a O    32.1144  -16.0182
            70  O6a O    34.2751  -14.6565
            71  C1a C    34.0641  -11.4409
            72  C1a C    34.8503  -13.5314
            73  C5a C    32.7473  -18.2300
            74  C1a C    33.7061  -20.8127
            75  C1a C    32.3126  -22.5642
            76  C1c C    33.0541  -16.9707
            77  O5a O    33.9490  -18.6392
            78  C1a C    34.2751  -16.3953
BOND        78
            1     1   2 1
            2     1   3 1 #Down
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     4   8 1
            8     4   9 1
            9    10   5 1 #Down
            10    7  11 1
            11    7  12 2
            12   10  13 1
            13   10  14 1
            14   11  15 1 #Up
            15   11  16 1
            16   13  17 1
            17   13  18 2
            18   14  19 1
            19   14  20 1
            20   15  21 1
            21   16  22 1
            22   16  23 1
            23   17  24 1
            24   21  25 1
            25   21  26 2
            26   24  27 1
            27   24  28 1 #Up
            28   25  29 1
            29   25  30 1 #Up
            30   27  31 1
            31   27  32 2
            32   29  33 1
            33   34  31 1 #Up
            34   33  35 1
            35   33  36 2
            36   34  37 1
            37   34  38 1
            38   35  39 1
            39   35  40 1
            40   37  41 1
            41   37  42 2
            42   38  43 1
            43   38  44 1
            44   39  45 1
            45   40  46 1
            46   40  47 1
            47   48  41 1 #Down
            48   45  49 1
            49   45  50 2
            50   48  51 1
            51   48  52 1
            52   49  53 1 #Down
            53   49  54 1
            54   51  55 1
            55   51  56 2
            56   52  57 1
            57   52  58 1
            58   53  59 1
            59   54  60 1
            60   54  61 1
            61   62  55 1 #Down
            62   59  63 1
            63   59  64 2
            64   62  65 1
            65   62  66 1
            66   63  67 1 #Up
            67   63  68 1
            68   65  69 1
            69   65  70 2
            70   66  71 1
            71   66  72 1
            72   67  73 1
            73   68  74 1
            74   68  75 1
            75   69  76 1
            76   73  77 2
            77   76  78 1 #Up
            78   73  76 1

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