KEGG   COMPOUND: C04881
Entry
C04881                      Compound                               

Name
N-Acetyl-beta-D-mannosaminyl-1,4-N-acetyl-D-glucosaminyldiphosphoundecaprenol;
N-Acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl-diphospho-ditrans,octacis-undecaprenol
Formula
C71H118N2O17P2
Exact mass
1332.7906
Mol weight
1333.6473
Structure
Remark
Same as: G00177
Reaction
Enzyme
2.4.1.187       2.7.8.44
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR03 Polyprenols
   PR0303 Bactoprenol diphosphates
    C04881  N-Acetyl-beta-D-mannosaminyl-1,4-N-acetyl-D-glucosaminyldiphosphoundecaprenol
Other DBs
PubChem: 7433
ChEBI: 132875
3DMET: B01800
NIKKAJI: J2.760.509E
KCF data

ATOM        92
            1   C1b C    22.5400  -11.7600
            2   C1b C    21.4900  -12.4600
            3   C2c C    20.2300  -11.7600
            4   C1a C    20.2300  -10.3600
            5   C1b C    19.0400  -13.8600
            6   C2b C    19.0400  -12.4600
            7   O2b O    17.2900  -14.9100
            8   C1a C    36.2600  -12.4600
            9   C2c C    35.0000  -11.7600
            10  C2b C    33.7400  -12.4600
            11  C1a C    35.0000  -10.3600
            12  C1b C    32.4800  -11.7600
            13  C1b C    31.2900  -12.4600
            14  C2c C    30.0300  -11.7600
            15  C2b C    28.7700  -12.4600
            16  C1a C    30.0300  -10.3600
            17  C1b C    27.5100  -11.7600
            18  C1b C    26.3200  -12.4600
            19  C2c C    25.0600  -11.7600
            20  C2b C    23.8000  -12.4600
            21  C1a C    25.0600  -10.3600
            22  P1b P    15.8200  -14.9100
            23  O2c O    14.3500  -14.9100
            24  O1c O    15.8200  -13.4400
            25  O1c O    15.8200  -16.3800
            26  P1b P    12.8800  -14.9100
            27  O2b O    11.4100  -14.9100
            28  O1c O    12.8800  -13.4400
            29  O1c O    12.8800  -16.3800
            30  C1y C    10.1976  -15.6100
            31  O2x O     9.0021  -14.9196
            32  C1y C     7.7896  -15.6195
            33  C1y C     7.7894  -17.0195
            34  C1y C     8.9849  -17.7099
            35  C1y C    10.1974  -17.0100
            36  C1b C     6.5771  -14.9195
            37  O1a O     8.9849  -19.1099
            38  O2a O     6.5770  -17.7195
            39  N1b N    11.4098  -17.7100
            40  C5a C    11.4098  -19.1100
            41  O5a O    10.1974  -19.8100
            42  C1a C    12.6223  -19.8100
            43  C1y C     5.3646  -18.4195
            44  O2x O     4.1674  -17.7280
            45  C1y C     2.9548  -18.4278
            46  C1y C     2.9545  -19.8278
            47  C1y C     4.1517  -20.5193
            48  C1y C     5.3643  -19.8195
            49  C1b C     1.7424  -17.7278
            50  O1a O     4.1517  -21.9193
            51  N1b N     6.5767  -20.5195
            52  O1a O     1.7421  -20.5278
            53  O1a O     1.7424  -16.3278
            54  C5a C     6.5767  -21.9195
            55  O5a O     5.3643  -22.6195
            56  C1a C     7.7892  -22.6195
            57  O1a O     6.5771  -13.5195
            58  C1b C    21.4900  -12.4600
            59  C2c C    20.2300  -11.7600
            60  C1a C    20.2300  -10.3600
            61  C1b C    19.0400  -13.8600
            62  C2b C    19.0400  -12.4600
            63  C1b C    21.4900  -12.4600
            64  C2c C    20.2300  -11.7600
            65  C1a C    20.2300  -10.3600
            66  C1b C    19.0400  -13.8600
            67  C2b C    19.0400  -12.4600
            68  C1b C    21.4900  -12.4600
            69  C2c C    20.2300  -11.7600
            70  C1a C    20.2300  -10.3600
            71  C1b C    19.0400  -13.8600
            72  C2b C    19.0400  -12.4600
            73  C1b C    21.4900  -12.4600
            74  C2c C    20.2300  -11.7600
            75  C1a C    20.2300  -10.3600
            76  C1b C    19.0400  -13.8600
            77  C2b C    19.0400  -12.4600
            78  C1b C    21.4900  -12.4600
            79  C2c C    20.2300  -11.7600
            80  C1a C    20.2300  -10.3600
            81  C1b C    19.0400  -13.8600
            82  C2b C    19.0400  -12.4600
            83  C1b C    21.4900  -12.4600
            84  C2c C    20.2300  -11.7600
            85  C1a C    20.2300  -10.3600
            86  C1b C    19.0400  -13.8600
            87  C2b C    19.0400  -12.4600
            88  C1b C    21.4900  -12.4600
            89  C2c C    20.2300  -11.7600
            90  C1a C    20.2300  -10.3600
            91  C1b C    19.0400  -13.8600
            92  C2b C    19.0400  -12.4600
BOND        93
            1    12  13 1
            2    13  14 1
            3    14  15 2
            4    14  16 1
            5    15  17 1
            6    10  12 1
            7     8   9 1
            8     9  10 2
            9    17  18 1
            10   18  19 1
            11   19  20 2
            12   19  21 1
            13   20   1 1
            14    9  11 1
            15    7  22 1
            16   22  23 1
            17   22  24 1
            18   22  25 2
            19   23  26 1
            20   26  27 1
            21   26  28 1
            22   26  29 2
            23   30  27 1 #Down
            24   30  31 1
            25   31  32 1
            26   32  33 1
            27   33  34 1
            28   34  35 1
            29   30  35 1
            30   32  36 1 #Up
            31   34  37 1 #Up
            32   33  38 1 #Down
            33   35  39 1 #Down
            34   39  40 1
            35   40  41 2
            36   40  42 1
            37   43  38 1 #Up
            38   43  44 1
            39   44  45 1
            40   45  46 1
            41   46  47 1
            42   47  48 1
            43   43  48 1
            44   45  49 1 #Up
            45   47  50 1 #Up
            46   48  51 1 #Up
            47   46  52 1 #Down
            48   49  53 1
            49   51  54 1
            50   54  55 2
            51   54  56 1
            52   36  57 1
            53    1   2 1
            54    3   4 1
            55    3   2 1
            56    5   6 1
            57    6   3 2
            58    5  58 1
            59   59  60 1
            60   59  58 1
            61   61  62 1
            62   62  59 2
            63   61  63 1
            64   64  65 1
            65   64  63 1
            66   66  67 1
            67   67  64 2
            68   66  68 1
            69   69  70 1
            70   69  68 1
            71   71  72 1
            72   72  69 2
            73   71  73 1
            74   74  75 1
            75   74  73 1
            76   76  77 1
            77   77  74 2
            78   76  78 1
            79   79  80 1
            80   79  78 1
            81   81  82 1
            82   82  79 2
            83   81  83 1
            84   84  85 1
            85   84  83 1
            86   86  87 1
            87   87  84 2
            88   86  88 1
            89   89  90 1
            90   89  88 1
            91   91  92 1
            92   92  89 2
            93   91   7 1
BRACKET     1    18.7600  -14.9800   18.7600   -9.7300
            1    21.7000   -9.7300   21.7000  -14.9800
            1  8
 ORIGINAL  1    2   3   4   5   6
 REPEAT    1   58  59  60  61  62  63  64  65  66  67  68  69  70  71  72  73
            1   74  75  76  77  78  79  80  81  82  83  84  85  86  87  88  89
            1   90  91  92

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