KEGG   COMPOUND: C15729
Entry
C15729                      Compound                               
Name
Chivosazole B
Formula
C48H69NO12
Exact mass
851.482
Mol weight
852.061
Structure
Sequence
0 Mak  1 Mak  2 Mtk  3 Mtd  4 Mad  5 Mad  6 Mak  7 Mak  8 Mtn
9 Ser  10 Mad  11 Mak  12 Mtd  13 Mtd  14 Mad  15 Mad  16 Man
  Gene
0-3 chiB [UP:Q2N3T1]; 4-8 chiC [UP:Q2N3T0]; 9-10 chiD
[UP:Q2N3S9]; 11-13 chiE [UP:Q2N3S8]; 14-16 chiF [UP:Q2N3S7]
  Organism
Polyangium cellulosum
  Type
PKNRP
Other DBs
PubChem: 47205055
ChEBI: 80058
NIKKAJI: J873.537I
LinkDB
KCF data

ATOM        61
            1   C8y C    25.7600  -23.0300
            2   C2b C    25.7600  -24.4300
            3   C2b C    26.9500  -25.1300
            4   C1a C    28.2100  -24.4300
            5   C2b C    26.9500  -26.5300
            6   C2b C    28.2100  -27.1600
            7   C1c C    29.4000  -26.5300
            8   C1c C    29.4000  -25.1300
            9   N5x N    26.8800  -22.1900
            10  C8y C    26.4600  -20.9300
            11  O2x O    25.0600  -20.9300
            12  C8x C    24.7100  -22.1900
            13  C1c C    27.3000  -19.8100
            14  C1c C    27.3000  -18.4100
            15  C1b C    28.4900  -17.7100
            16  C1c C    29.7500  -18.4100
            17  C2b C    30.8700  -17.7100
            18  C2b C    32.0600  -18.4100
            19  C2b C    33.3200  -17.7100
            20  C2b C    34.5100  -18.4100
            21  C2b C    35.6300  -17.7100
            22  C2b C    36.8900  -18.4100
            23  C1a C    28.6300  -20.2300
            24  O1a O    26.1100  -17.7100
            25  O1a O    29.7500  -19.8100
            26  C1c C    36.8900  -19.8100
            27  C1a C    35.7000  -20.5100
            28  C1c C    38.0800  -20.5100
            29  O7a O    38.0800  -21.8400
            30  C7a C    39.1300  -23.1700
            31  C2b C    30.1000  -23.9400
            32  C2c C    31.4300  -23.9400
            33  C1a C    32.1300  -25.1300
            34  C2b C    32.1300  -22.7500
            35  C2b C    33.5300  -22.7500
            36  C2b C    34.2300  -23.9400
            37  C2b C    35.5600  -23.9400
            38  C2b C    36.2600  -25.1300
            39  C2b C    37.6600  -25.1300
            40  O6a O    40.5300  -23.1700
            41  O2a O    30.5900  -27.1600
            42  C1c C    39.2700  -19.8100
            43  C1c C    40.4600  -20.5100
            44  C1b C    41.6500  -19.8100
            45  C1c C    42.8400  -20.5100
            46  C1a C    44.1000  -19.8100
            47  C1a C    39.2700  -18.4100
            48  O1a O    40.4600  -21.8400
            49  O1a O    42.8400  -21.8400
            50  C1y C    30.5900  -28.5600
            51  C1y C    29.3300  -29.2600
            52  C1y C    29.3300  -30.6600
            53  C1y C    30.5200  -31.3600
            54  C1y C    31.7800  -30.6600
            55  O2x O    31.7800  -29.2600
            56  C1a C    32.9700  -31.3600
            57  O1a O    30.5200  -32.6900
            58  O2a O    28.2100  -31.3600
            59  C1a C    27.0200  -30.6600
            60  O2a O    28.1400  -28.5600
            61  C1a C    27.0200  -29.2600
BOND        63
            1     1   2 1
            2     2   3 2
            3     3   5 1
            4     5   6 2
            5     6   7 1
            6     7   8 1
            7     4   8 1
            8     1   9 1
            9     9  10 2
            10   10  11 1
            11   11  12 1
            12    1  12 2
            13   10  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   17  18 2
            19   18  19 1
            20   19  20 2
            21   20  21 1
            22   21  22 2
            23   13  23 1
            24   14  24 1
            25   16  25 1
            26   22  26 1
            27   26  27 1
            28   26  28 1
            29   28  29 1
            30   29  30 1
            31   31  32 2
            32   32  33 1
            33   32  34 1
            34   34  35 2
            35   35  36 1
            36   36  37 2
            37   37  38 1
            38   38  39 2
            39   31   8 1
            40   30  39 1
            41   30  40 2
            42    7  41 1
            43   28  42 1
            44   42  43 1
            45   43  44 1
            46   44  45 1
            47   45  46 1
            48   42  47 1
            49   43  48 1
            50   45  49 1
            51   50  41 1 #Down
            52   50  51 1
            53   51  52 1
            54   52  53 1
            55   53  54 1
            56   54  55 1
            57   50  55 1
            58   54  56 1 #Down
            59   53  57 1 #Up
            60   52  58 1 #Down
            61   58  59 1
            62   51  60 1 #Up
            63   60  61 1

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