KEGG   COMPOUND: C15656
Entry
C15656                      Compound                               
Name
alpha-N-Acetyl-D-glucosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosylproteoglycan;
[Protein]-3-O-(alpha-D-GlcNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-serine
Formula
C35H55N3O28R2
Structure
Remark
Same as: G00162
Comment
Generic compound in reaction hierarchy
Reaction
Pathway
map00534  Glycosaminoglycan biosynthesis - heparan sulfate / heparin
map01100  Metabolic pathways
Enzyme
Other DBs
PubChem: 17396645
ChEBI: 80007
LinkDB
KCF data

ATOM        68
            1   C1y C    25.5641  -11.0027
            2   C1y C    25.5641  -12.3549
            3   O2a O    26.7464  -10.3237
            4   O2x O    24.4120  -10.3237
            5   C1y C    24.4120  -13.0157
            6   O1a O    26.7464  -13.0157
            7   C1b C    28.0015  -11.0514
            8   C1x C    23.2297  -11.0027
            9   C1y C    23.2297  -12.3549
            10  O1a O    24.4120  -14.3618
            11  C1c C    29.2503  -10.3237
            12  O2a O    22.0778  -13.0157
            13  C5a C    30.5176  -11.0514
            14  N1b N    29.2503   -8.8807
            15  N1b N    31.7727  -10.3237
            16  O5a O    30.5176  -12.5065
            17  C5a C    30.5176   -8.1532
            18  R   R    33.0217  -11.0514
            19  O5a O    30.5176   -6.7041
            20  R   R    31.7727   -8.8807
            21  C1y C    20.8656  -13.7155
            22  O2x O    19.6475  -13.0123
            23  C1y C    18.4355  -13.7121
            24  C1y C    18.4355  -15.1117
            25  C1y C    19.6534  -15.8150
            26  C1y C    20.8656  -15.1151
            27  O2a O    19.6534  -17.2146
            28  C1y C    18.4414  -17.9144
            29  C1b C    17.2234  -13.0123
            30  O1a O    17.2234  -11.6128
            31  O2x O    17.2047  -17.2001
            32  C1y C    15.9926  -17.8996
            33  C1y C    15.9923  -19.2992
            34  C1y C    17.2288  -20.0136
            35  C1y C    18.4411  -19.3140
            36  C1b C    14.7805  -17.1998
            37  O1a O    14.7805  -15.8001
            38  O1a O    17.2234  -15.8116
            39  O1a O    14.7802  -19.9990
            40  O2a O    17.2288  -21.4133
            41  O1a O    22.0778  -15.8150
            42  O1a O    19.6531  -20.0138
            43  C1y C    16.0153  -22.1139
            44  O2x O    14.8320  -21.4309
            45  C1y C    13.6185  -22.1317
            46  C1y C    13.6187  -23.5329
            47  C1y C    14.8021  -24.2159
            48  C1y C    16.0155  -23.5151
            49  C6a C    12.4051  -21.4311
            50  O6a O    12.4051  -20.0299
            51  O6a O    11.1916  -22.1317
            52  O1a O    14.8021  -25.6172
            53  O2a O    12.4053  -24.2336
            54  O1a O    17.2290  -24.2157
            55  C1y C    11.1929  -24.9336
            56  O2x O     9.9800  -24.2333
            57  C1y C     8.7675  -24.9333
            58  C1y C     8.7675  -26.3333
            59  C1y C     9.9804  -27.0336
            60  C1y C    11.1929  -26.3336
            61  C1b C     7.5551  -24.2333
            62  O1a O     7.5551  -22.8333
            63  N1b N    12.4053  -27.0336
            64  C5a C    12.4053  -28.4336
            65  O5a O    11.1929  -29.1336
            66  C1a C    13.6178  -29.1336
            67  O1a O     7.5551  -27.0333
            68  O1a O     9.9804  -28.4336
BOND        72
            1     1   2 1
            2     1   3 1 #Up
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 1 #Up
            10    7  11 1
            11    9  12 1 #Down
            12   11  13 1
            13   11  14 1 #Down
            14   13  15 1
            15   13  16 2
            16   14  17 1
            17   15  18 1
            18   17  19 2
            19   17  20 1
            20    8   9 1
            21   21  12 1 #Up
            22   21  22 1
            23   22  23 1
            24   23  24 1
            25   24  25 1
            26   25  26 1
            27   21  26 1
            28   25  27 1 #Up
            29   28  27 1 #Up
            30   23  29 1 #Up
            31   29  30 1
            32   28  31 1
            33   31  32 1
            34   32  33 1
            35   33  34 1
            36   34  35 1
            37   28  35 1
            38   32  36 1 #Up
            39   36  37 1
            40   24  38 1 #Up
            41   33  39 1 #Up
            42   34  40 1 #Up
            43   26  41 1 #Down
            44   35  42 1 #Down
            45   43  40 1 #Up
            46   43  44 1
            47   44  45 1
            48   45  46 1
            49   46  47 1
            50   47  48 1
            51   43  48 1
            52   45  49 1 #Up
            53   49  50 1
            54   49  51 2
            55   47  52 1 #Up
            56   46  53 1 #Down
            57   48  54 1 #Down
            58   55  53 1 #Down
            59   55  56 1
            60   56  57 1
            61   57  58 1
            62   58  59 1
            63   59  60 1
            64   55  60 1
            65   57  61 1 #Up
            66   61  62 1
            67   60  63 1 #Down
            68   63  64 1
            69   64  65 2
            70   64  66 1
            71   58  67 1 #Down
            72   59  68 1 #Up

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