KEGG   COMPOUND: C03953
Entry
C03953                      Compound                               
Name
N-Acetylglucosamine 4-sulfate;
N-Acetyl-D-glucosamine 4-sulfate
Formula
C8H15NO9S
Exact mass
301.0468
Mol weight
301.271
Structure
Other DBs
PubChem: 6674
NIKKAJI: J2.205.870C
LinkDB
KCF data

ATOM        19
            1   C1y C    25.2032  -16.0557
            2   C1y C    25.2032  -14.7003
            3   C1y C    26.3721  -16.7333
            4   O2a O    24.0467  -16.7333
            5   O2x O    26.3721  -14.0226
            6   C1b C    24.0467  -14.0226
            7   C1y C    27.5533  -16.0557
            8   O1a O    26.3721  -18.0824
            9   S4a S    22.4737  -16.7272
            10  C1y C    27.5533  -14.7003
            11  O1a O    22.6477  -13.9774
            12  N1b N    28.7285  -16.7333
            13  O1d O    22.4798  -15.3718
            14  O1d O    21.1245  -16.7272
            15  O1d O    22.4798  -18.1074
            16  O1a O    28.7985  -13.8826
            17  C5a C    29.9124  -16.0300
            18  C1a C    31.1249  -16.7300
            19  O5a O    29.9037  -14.7701
BOND        19
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 1 #Up
            6     3   7 1
            7     3   8 1 #Up
            8     4   9 1
            9     5  10 1
            10    6  11 1
            11    7  12 1 #Down
            12    9  13 2
            13    9  14 1
            14    9  15 2
            15   10  16 1 #Up
            16    7  10 1
            17   12  17 1
            18   17  18 1
            19   17  19 2

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