KEGG   COMPOUND: C21152Help
Entry
C21152                      Compound                               

Name
N,N'-Diacetylchitobiose 6'-phosphate
Formula
C16H29N2O14P
Exact mass
504.1356
Mol weight
504.3802
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map02060  Phosphotransferase system (PTS)
Enzyme
Other DBs
PubChem: 313369412
LinkDB All DBs
KCF data Show

ATOM        33
            1   C1y C    16.8162  -16.2402
            2   C1y C    16.8162  -17.6216
            3   O2a O    18.0249  -15.5435
            4   O2x O    15.6134  -15.5435
            5   C1y C    15.6134  -18.3181
            6   N1b N    17.8761  -18.6635
            7   C1y C    19.2156  -14.8470
            8   C1y C    14.4285  -16.2402
            9   C1y C    14.4285  -17.6216
            10  O1a O    15.6194  -19.6936
            11  C1y C    19.2156  -13.4656
            12  C1y C    20.4005  -15.5435
            13  C1b C    13.2377  -15.5435
            14  O1a O    13.2377  -18.3181
            15  O2x O    20.4005  -12.7689
            16  C1b C    18.0249  -12.7689
            17  C1y C    21.6033  -14.8470
            18  O1a O    20.4065  -16.9189
            19  C1y C    21.6033  -13.4656
            20  O1a O    16.9709  -13.6739
            21  N1b N    22.6632  -15.8888
            22  O1a O    22.8059  -12.7689
            23  C5a C    19.1314  -17.9492
            24  C1a C    20.3692  -18.6638
            25  O5a O    19.1360  -16.5203
            26  C5a C    23.9191  -15.1623
            27  C1a C    25.1569  -15.8769
            28  O5a O    23.9186  -13.7333
            29  O2b O    13.2377  -14.1435
            30  P1b P    11.8377  -14.1435
            31  O1c O    11.8377  -12.7435
            32  O1c O    10.4377  -14.1435
            33  O1c O    11.8377  -15.5435
BOND        34
            1     1   2 1
            2     1   3 1 #Up
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Down
            6     7   3 1 #Down
            7     4   8 1
            8     5   9 1
            9     5  10 1 #Up
            10    7  11 1
            11    7  12 1
            12    8  13 1 #Up
            13    9  14 1 #Down
            14   11  15 1
            15   11  16 1 #Up
            16   12  17 1
            17   12  18 1 #Up
            18   15  19 1
            19   16  20 1
            20   17  21 1 #Down
            21   19  22 1 #Either
            22    8   9 1
            23   17  19 1
            24    6  23 1
            25   23  24 1
            26   23  25 2
            27   21  26 1
            28   26  27 1
            29   26  28 2
            30   13  29 1
            31   29  30 1
            32   30  31 1
            33   30  32 1
            34   30  33 2

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