KEGG   COMPOUND: C04540Help
Entry
C04540                      Compound                               

Name
N4-(Acetyl-beta-D-glucosaminyl)asparagine;
N4-(beta-N-Acetyl-D-glucosaminyl)-L-asparagine;
1-beta-Aspartyl-N-acetyl-D-glucosaminylamine
Formula
C12H21N3O8
Exact mass
335.1329
Mol weight
335.3104
Structure
Mol fileKCF fileDB search
Reaction
Enzyme
3.2.2.11        3.5.1.26
Other DBs
PubChem: 7146
ChEBI: 17261
NIKKAJI: J37.492J
LinkDB All DBs
KCF data Show

ATOM        23
            1   C1y C    22.5080  -16.8768
            2   C1y C    22.5080  -18.2493
            3   O2x O    21.3166  -16.1970
            4   C1y C    21.3166  -18.9417
            5   C1y C    20.1438  -16.8768
            6   C1y C    20.1438  -18.2493
            7   O1a O    21.3166  -20.3017
            8   C1b C    18.9648  -16.1970
            9   O1a O    18.9648  -18.9230
            10  O1a O    17.7683  -16.8883
            11  N1b N    23.7454  -16.1580
            12  C5a C    23.7416  -14.7700
            13  O5a O    22.5185  -14.0684
            14  C1b C    24.9434  -14.0717
            15  C1c C    26.1393  -14.7579
            16  C6a C    27.3227  -14.0704
            17  O6a O    28.5197  -14.7573
            18  O6a O    27.3189  -12.6701
            19  N1a N    26.1434  -16.1696
            20  N1b N    23.7544  -18.9665
            21  C5a C    23.7544  -20.3665
            22  O5a O    22.5223  -21.0781
            23  C1a C    24.9499  -21.0569
BOND        23
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     4   6 1
            6     4   7 1 #Up
            7     5   8 1 #Up
            8     6   9 1 #Down
            9     5   6 1
            10    8  10 1
            11    1  11 1 #Up
            12   11  12 1
            13   12  13 2
            14   12  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   16  18 2
            19   15  19 1 #Up
            20    2  20 1 #Down
            21   20  21 1
            22   21  22 2
            23   21  23 1

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