KEGG   COMPOUND: C15704
Entry
C15704                      Compound                               
Name
Tubulysin D
Formula
C43H65N5O9S
Exact mass
827.4503
Mol weight
828.0693
Structure
Sequence
0 Pip  1 Ile  2 Val  3 Mao  4 Cys  5 Phe  6 Mtn
  Gene
0 TubB [UP:Q5ZPB0]; 1-2 TubC [UP:Q5ZPA9]; 3-4 TubD [UP:Q5ZPA8];
5 TubE [UP:Q5ZPA7]; 6 TubF [UP:Q5ZPA6]
  Organism
Angiococcus disciformis
  Type
PKNRP
Comment
0 Pip is modified by N-methyl. (i.e. N-Methyl-L-pipecolic acid)
Other DBs
PubChem: 47205030
ChEBI: 80036
KNApSAcK: C00015655
NIKKAJI: J1.435.030F
LinkDB
KCF data

ATOM        58
            1   C1x C    12.9500  -20.7200
            2   C1x C    12.9500  -22.1200
            3   N1y N    14.1400  -22.8200
            4   C1y C    15.4000  -22.1200
            5   C1x C    15.4000  -20.7200
            6   C1x C    14.1400  -20.0200
            7   C5a C    16.5900  -22.8200
            8   N1b N    17.8500  -22.1200
            9   C1c C    19.0400  -22.8200
            10  C5a C    20.2300  -22.1200
            11  N1c N    21.4900  -22.8200
            12  C1c C    22.6800  -22.1200
            13  C1b C    23.9400  -22.8200
            14  C1c C    25.2000  -22.1200
            15  C8y C    26.3900  -22.8200
            16  O5a O    16.5900  -24.2200
            17  C1a C    14.1400  -24.2200
            18  C1c C    19.0400  -24.2200
            19  C1a C    20.2300  -24.9200
            20  C1b C    17.8500  -24.9200
            21  C1a C    17.8500  -26.3200
            22  O5a O    20.2300  -20.7200
            23  C1b C    21.4900  -24.2200
            24  O7a O    22.6800  -24.9200
            25  C7a C    22.6800  -26.3200
            26  O6a O    21.4900  -27.0200
            27  C1b C    23.9400  -27.0200
            28  C1c C    23.9400  -28.4900
            29  C1a C    22.6800  -29.1900
            30  C1a C    25.1300  -29.1900
            31  C1c C    22.6800  -20.7200
            32  C1a C    23.9400  -20.0200
            33  C1a C    21.4900  -20.0200
            34  O7a O    25.2000  -20.7200
            35  C7a C    26.3900  -20.0200
            36  C1a C    27.5800  -20.7200
            37  O6a O    26.3900  -18.6200
            38  S2x S    26.8100  -24.1500
            39  C8x C    28.2100  -24.1500
            40  C8y C    28.6300  -22.8200
            41  N5x N    27.5100  -21.9800
            42  C5a C    29.8200  -22.1200
            43  N1b N    31.0800  -22.8200
            44  C1c C    32.2700  -22.1200
            45  C1b C    33.4600  -22.8200
            46  O5a O    29.8200  -20.7200
            47  C1b C    32.2700  -20.7200
            48  C8y C    33.4600  -20.0200
            49  C8x C    34.6500  -20.7200
            50  C8x C    35.9100  -20.0200
            51  C8x C    35.9100  -18.6200
            52  C8x C    34.7200  -17.9200
            53  C8x C    33.4600  -18.6200
            54  C1c C    33.4600  -24.2200
            55  C6a C    34.6500  -24.9200
            56  C1a C    32.2700  -24.9200
            57  O6a O    34.6500  -26.3200
            58  O6a O    35.8400  -24.2200
BOND        60
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16    7  16 2
            17    3  17 1
            18    9  18 1
            19   18  19 1 #Up
            20   18  20 1
            21   20  21 1
            22   10  22 2
            23   11  23 1
            24   23  24 1
            25   24  25 1
            26   25  26 2
            27   25  27 1
            28   27  28 1
            29   28  29 1
            30   28  30 1
            31   12  31 1 #Up
            32   31  32 1
            33   31  33 1
            34   14  34 1 #Up
            35   34  35 1
            36   35  36 1
            37   35  37 2
            38   38  39 1
            39   39  40 2
            40   40  41 1
            41   41  15 2
            42   38  15 1
            43   40  42 1
            44   42  43 1
            45   43  44 1
            46   44  45 1
            47   42  46 2
            48   44  47 1 #Up
            49   47  48 1
            50   48  49 2
            51   49  50 1
            52   50  51 2
            53   51  52 1
            54   52  53 2
            55   48  53 1
            56   45  54 1
            57   54  55 1
            58   54  56 1 #Up
            59   55  57 1
            60   55  58 2

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