KEGG   COMPOUND: C15762
Entry
C15762                      Compound                               
Name
Onnamide A;
Onnamide
Formula
C39H63N5O12
Exact mass
793.4473
Mol weight
793.9438
Structure
Sequence
0 Mak  1 Mte  2 Mak  3 Man  4 Gly  5 Mak  6 Mtk  7 Mak  8 Mae
9 Mad  10 Mad  11 Mad  12 Man
  Gene
0-3 onnB [UP:Q5MP07]; 4-7 OnnI [UP:Q5MP00];
  Organism
Theonella swinhoei (most likelly Pseudomonas sp.)
  Type
PKNRP
Other DBs
CAS: 115204-07-4
PubChem: 47205088
ChEBI: 80086
NIKKAJI: J276.645K
LinkDB
KCF data

ATOM        56
            1   O2x O    29.5717  -27.8064
            2   C1x C    29.5717  -29.2079
            3   O2x O    30.7854  -29.9086
            4   C1y C    31.9992  -29.2079
            5   C1y C    31.9992  -27.8064
            6   C1y C    30.7854  -27.1056
            7   C1y C    33.2129  -29.9086
            8   C1z C    34.4267  -29.2079
            9   C1y C    34.4267  -27.8064
            10  O2x O    33.2129  -27.1056
            11  C1b C    35.6207  -27.1056
            12  C1c C    36.8345  -27.8064
            13  C1b C    38.0482  -27.1056
            14  C1b C    39.2619  -27.8064
            15  C1b C    40.4757  -27.1056
            16  C2b C    41.6894  -27.8064
            17  C2b C    42.9031  -27.1056
            18  C2b C    44.1169  -27.8064
            19  C2b C    45.3306  -27.1056
            20  C2b C    46.5444  -27.8064
            21  C2b C    47.7582  -27.1056
            22  C5a C    48.9719  -27.8064
            23  N1b N    50.1857  -27.1056
            24  C1c C    51.3994  -27.8064
            25  C1b C    52.6131  -27.1056
            26  O1a O    36.8345  -29.2077
            27  O5a O    48.9719  -29.2079
            28  C6a C    51.3994  -29.2075
            29  O6a O    50.1602  -29.9233
            30  O6a O    52.5875  -29.8936
            31  C1b C    53.8369  -27.8123
            32  C1b C    55.0388  -27.1182
            33  N1b N    56.2249  -27.8029
            34  C2c C    57.4188  -27.1135
            35  N1a N    58.6088  -27.8005
            36  N2a N    57.4188  -25.7044
            37  N1b N    30.7854  -25.7041
            38  C5a C    29.5550  -24.9935
            39  C1c C    29.5550  -23.5920
            40  O5a O    28.3497  -25.6895
            41  O1a O    30.7769  -22.8864
            42  C1z C    28.3580  -22.9011
            43  O2x O    28.3579  -21.4997
            44  C1y C    27.1442  -20.7990
            45  C1y C    25.9304  -21.4998
            46  C2y C    25.9305  -22.9012
            47  C1x C    27.1443  -23.6018
            48  O2a O    29.5717  -22.2003
            49  C1a C    29.5675  -20.7988
            50  C1a C    27.1441  -19.3975
            51  C1a C    24.7146  -20.7979
            52  C2a C    24.7148  -23.6031
            53  C1a C    34.7895  -30.5616
            54  O2a O    33.2129  -31.3101
            55  C1a C    34.4288  -32.0121
            56  C1a C    35.7804  -28.8452
BOND        58
            1     1   2 1
            2     2   3 1
            3     4   3 1 #Up
            4     4   5 1
            5     5   6 1
            6     6   1 1 #Down
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    9  11 1 #Down
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 2
            19   17  18 1
            20   18  19 2
            21   19  20 1
            22   20  21 2
            23   21  22 1
            24   22  23 1
            25   23  24 1
            26   24  25 1
            27   12  26 1 #Up
            28   22  27 2
            29   24  28 1
            30   28  29 2
            31   28  30 1
            32   25  31 1
            33   31  32 1
            34   32  33 1
            35   33  34 1
            36   34  35 1
            37   34  36 2
            38    6  37 1
            39   37  38 1
            40   38  39 1
            41   38  40 2
            42   39  41 1 #Down
            43   39  42 1
            44   42  43 1
            45   43  44 1
            46   44  45 1
            47   45  46 1
            48   46  47 1
            49   42  47 1
            50   42  48 1 #Down
            51   48  49 1
            52   44  50 1 #Up
            53   45  51 1 #Up
            54   46  52 2
            55    8  53 1
            56    7  54 1 #Down
            57   54  55 1
            58    8  56 1

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