KEGG   COMPOUND: C19884Help
Entry
C19884                      Compound                               

Name
Lipid IIA
Formula
C73H139N3O26P2
Exact mass
1535.9122
Mol weight
1536.8368
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00540  Lipopolysaccharide biosynthesis
Enzyme
2.3.1.251       2.4.2.43
Other DBs
PubChem: 135626350
KCF data Show

ATOM        104
            1   C1x C    21.0272   -5.0456
            2   C1y C    21.0272   -6.4238
            3   C1y C    22.1987   -7.1129
            4   C1y C    23.4391   -6.4238
            5   C1y C    23.4391   -5.0456
            6   O2x O    22.1987   -4.3566
            7   N1a N    19.8558   -7.1129
            8   O1a O    22.1817   -8.4910
            9   O1a O    24.1281   -7.6174
            10  C1y C    16.9616  -12.2811
            11  C1y C    15.8590  -11.5920
            12  C1y C    18.2020  -11.5920
            13  O7a O    16.9616  -13.6593
            14  C1y C    15.8590  -10.2138
            15  O2b O    14.6875  -12.2811
            16  C1y C    18.2020  -10.2138
            17  N1b N    19.3734  -12.2811
            18  C7a C    15.8590  -14.2795
            19  O2x O    16.9616   -9.5247
            20  C1b C    14.6187   -9.5247
            21  P1b P    13.3094  -12.2811
            22  O2a O    19.3734   -9.5247
            23  C5a C    19.3734  -13.6593
            24  C1b C    15.8590  -15.6577
            25  O6a O    14.6875  -13.6593
            26  O1a O    14.6187   -8.1466
            27  O1c O    13.3094  -10.9029
            28  O1c O    11.9312  -12.2811
            29  O1c O    13.3094  -13.6593
            30  C1b C    20.5448   -8.8356
            31  C1b C    20.5448  -14.2795
            32  O5a O    18.2020  -14.2795
            33  C1c C    14.6875  -16.3467
            34  C1y C    21.7853   -9.5247
            35  C1c C    20.5448  -15.6577
            36  C1b C    14.6875  -17.7249
            37  O1a O    13.5162  -15.6577
            38  C1y C    21.7853  -10.9029
            39  O2x O    22.9566   -8.8356
            40  C1b C    19.3734  -16.3467
            41  O1a O    21.7853  -16.3467
            42  C1b C    13.5162  -18.4140
            43  C1y C    22.9566  -11.5920
            44  O1a O    20.5448  -11.2475
            45  C1y C    24.1281   -9.5247
            46  C1b C    19.3734  -17.7249
            47  C1b C    13.5162  -19.7922
            48  C1y C    24.1281  -10.9029
            49  O7a O    22.9566  -12.9701
            50  O2b O    26.1265   -7.3886
            51  C1b C    18.2020  -18.4140
            52  C1b C    12.2758  -20.4812
            53  N1b N    26.0576  -11.5920
            54  C7a C    24.1281  -13.6593
            55  P1b P    26.1265   -6.0792
            56  C1b C    18.2020  -19.7922
            57  C1b C    12.2758  -21.8594
            58  C5a C    27.2980  -10.9029
            59  C1b C    24.1281  -14.9685
            60  O6a O    25.2307  -12.9701
            61  O1c O    24.8172   -6.0104
            62  O1c O    27.5047   -6.0792
            63  C1b C    16.9616  -20.4812
            64  C1b C    11.1043  -22.4796
            65  C1b C    28.4695  -11.5920
            66  O5a O    27.3669   -9.5247
            67  C1c C    25.2996  -15.6577
            68  C1b C    16.9616  -21.8594
            69  C1b C    11.1043  -23.8578
            70  C1c C    28.4695  -12.9701
            71  C1b C    25.2996  -17.0358
            72  O1a O    26.4711  -14.9685
            73  C1b C    15.8590  -22.4796
            74  C1b C     9.9328  -24.5470
            75  C1b C    29.6408  -13.6593
            76  O1a O    27.2980  -13.6593
            77  C1b C    26.4711  -17.7249
            78  C1b C    15.8590  -23.8578
            79  C1b C     9.9328  -25.9251
            80  C1b C    29.6408  -14.9685
            81  C1b C    26.4711  -19.1031
            82  C1b C    14.6875  -24.5470
            83  C1b C     8.6925  -26.6142
            84  C1b C    30.8812  -15.7266
            85  C1b C    27.6425  -19.7922
            86  C1b C    14.6875  -25.9251
            87  C1a C     8.6925  -27.9924
            88  C1b C    30.8812  -17.1048
            89  C1b C    27.6425  -21.1704
            90  C1a C    13.5162  -26.6142
            91  C1b C    32.0527  -17.7938
            92  C1b C    28.8829  -21.8594
            93  C1b C    32.0527  -19.1720
            94  C1b C    28.8829  -23.1688
            95  C1b C    33.1553  -19.8611
            96  C1b C    30.0543  -23.8578
            97  C1b C    33.1553  -21.2393
            98  C1b C    30.0543  -25.2360
            99  C1b C    34.3956  -21.9284
            100 C1b C    31.2258  -25.9251
            101 C1b C    34.3956  -23.2376
            102 C1a C    31.2258  -27.3033
            103 C1a C    35.5671  -23.9267
            104 O2b O    26.1265   -4.7011
BOND        106
            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     2   7 1 #Up
            8     3   8 1 #Up
            9     4   9 1 #Down
            10   10  11 1
            11   10  12 1
            12   10  13 1 #Up
            13   11  14 1
            14   11  15 1 #Down
            15   12  16 1
            16   12  17 1 #Down
            17   13  18 1
            18   14  19 1
            19   14  20 1 #Up
            20   15  21 1
            21   16  22 1 #Up
            22   17  23 1
            23   18  24 1
            24   18  25 2
            25   20  26 1
            26   21  27 1
            27   21  28 1
            28   21  29 2
            29   22  30 1
            30   23  31 1
            31   23  32 2
            32   24  33 1
            33   34  30 1 #Up
            34   31  35 1
            35   33  36 1
            36   33  37 1 #Up
            37   34  38 1
            38   34  39 1
            39   35  40 1
            40   35  41 1 #Down
            41   36  42 1
            42   38  43 1
            43   38  44 1 #Down
            44   39  45 1
            45   40  46 1
            46   42  47 1
            47   43  48 1
            48   43  49 1 #Up
            49   45  50 1 #Down
            50   46  51 1
            51   47  52 1
            52   48  53 1 #Down
            53   49  54 1
            54   50  55 1
            55   51  56 1
            56   52  57 1
            57   53  58 1
            58   54  59 1
            59   54  60 2
            60   55  61 1
            61   55  62 2
            62   56  63 1
            63   57  64 1
            64   58  65 1
            65   58  66 2
            66   59  67 1
            67   63  68 1
            68   64  69 1
            69   65  70 1
            70   67  71 1
            71   67  72 1 #Down
            72   68  73 1
            73   69  74 1
            74   70  75 1
            75   70  76 1 #Up
            76   71  77 1
            77   73  78 1
            78   74  79 1
            79   75  80 1
            80   77  81 1
            81   78  82 1
            82   79  83 1
            83   80  84 1
            84   81  85 1
            85   82  86 1
            86   83  87 1
            87   84  88 1
            88   85  89 1
            89   86  90 1
            90   88  91 1
            91   89  92 1
            92   91  93 1
            93   92  94 1
            94   93  95 1
            95   94  96 1
            96   95  97 1
            97   96  98 1
            98   97  99 1
            99   98 100 1
            100  99 101 1
            101 100 102 1
            102 101 103 1
            103  16  19 1
            104  45  48 1
            105  55 104 1
            106   5 104 1 #Down

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