KEGG   COMPOUND: C04923
Entry
C04923                      Compound                               
Name
1,3-alpha-D-Mannosyl-(1,2-N-acetyl-alpha-D-glucosaminyl)-1,2-alpha-D-mannosyl-1,2-alpha-D-mannosyl-D-mannose
Formula
C32H55NO26
Exact mass
869.3012
Mol weight
869.7702
Structure
Remark
Same as: G07376
Reaction
Enzyme
Other DBs
PubChem: 7469
ChEBI: 29111
NIKKAJI: J2.754.532G
KCF data

ATOM        59
            1   C1y C    32.0554  -23.9430
            2   C1y C    30.8956  -24.6131
            3   C1y C    32.0554  -22.6150
            4   N1b N    33.0749  -24.9451
            5   C1y C    29.7534  -23.9430
            6   O1a O    30.9014  -25.9353
            7   O2x O    30.8956  -21.9451
            8   O2a O    32.5018  -19.9457
            9   C5a C    34.3855  -25.6675
            10  C1y C    29.7534  -22.6150
            11  O1a O    28.6123  -24.6131
            12  C1a C    35.6739  -25.0034
            13  O5a O    34.3913  -27.2868
            14  C1b C    28.6123  -21.9451
            15  O1a O    28.7432  -20.8343
            16  O1a O    25.2133  -17.7182
            17  C1b C    26.4456  -16.9689
            18  C1y C    27.5024  -17.5778
            19  C1y C    27.5024  -18.8146
            20  O2x O    28.5521  -16.9689
            21  C1y C    28.5521  -19.4354
            22  O1a O    26.4398  -19.4120
            23  C1y C    29.6194  -17.5778
            24  C1y C    29.6194  -18.8146
            25  O2a O    30.8458  -16.0376
            26  O1a O    22.0978  -21.7309
            27  C1b C    23.0899  -21.2430
            28  C1y C    24.1467  -21.8520
            29  C1y C    24.1467  -23.0816
            30  O2x O    25.1965  -21.2430
            31  C1y C    25.1965  -23.7094
            32  O1a O    23.0841  -23.6860
            33  C1y C    26.2566  -21.8520
            34  C1y C    26.2566  -23.0816
            35  O1a O    25.1965  -24.9217
            36  O2a O    27.8644  -21.1522
            37  O1a O    27.3132  -23.6953
            38  O1a O    25.0790  -12.7235
            39  C1b C    26.3113  -12.1015
            40  C1y C    27.3681  -12.7103
            41  C1y C    27.3681  -13.9470
            42  O2x O    28.4180  -12.1015
            43  C1y C    28.4180  -14.5679
            44  O1a O    26.3056  -14.5515
            45  C1y C    29.4851  -12.7103
            46  C1y C    29.4851  -13.9470
            47  O1a O    28.4180  -15.7800
            48  O2a O    30.7186  -10.8027
            49  O1a O    25.0083   -7.7359
            50  C1b C    26.2477   -7.0219
            51  C1y C    27.2976   -7.6379
            52  C1y C    27.2976   -8.8676
            53  O2x O    28.3473   -7.0219
            54  C1y C    28.3473   -9.4883
            55  O1a O    26.2420   -9.4721
            56  C1y C    29.4144   -7.6379
            57  C1y C    29.4144   -8.8676
            58  O1a O    28.3473  -10.7077
            59  O1a O    30.4713   -7.0160
BOND        63
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5    26  27 1
            6    28  27 1 #Up
            7    28  29 1
            8    28  30 1
            9    29  31 1
            10   29  32 1 #Down
            11   30  33 1
            12   31  34 1
            13   31  35 1 #Up
            14   33  36 1 #Down
            15   33  34 1
            16    2   6 1 #Up
            17   34  37 1 #Up
            18   21  36 1 #Up
            19    3   7 1
            20    3   8 1 #Down
            21    4   9 1
            22    5  10 1
            23   16  17 1
            24   18  17 1 #Up
            25   18  19 1
            26   18  20 1
            27   19  21 1
            28   19  22 1 #Down
            29   20  23 1
            30   38  39 1
            31   40  39 1 #Up
            32   40  41 1
            33   40  42 1
            34   41  43 1
            35   41  44 1 #Down
            36   42  45 1
            37   43  46 1
            38   43  47 1 #Up
            39   45  48 1 #Down
            40   45  46 1
            41   46  25 1 #Up
            42   21  24 1
            43   23  25 1 #Down
            44   23  24 1
            45   24   8 1 #Up
            46    5  11 1 #Down
            47    9  12 1
            48    9  13 2
            49   10  14 1 #Up
            50   14  15 1
            51    7  10 1
            52   49  50 1
            53   51  50 1 #Up
            54   51  52 1
            55   51  53 1
            56   52  54 1
            57   52  55 1 #Down
            58   53  56 1
            59   54  57 1
            60   54  58 1 #Up
            61   56  59 1 #Either
            62   56  57 1
            63   57  48 1 #Up

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