KEGG   COMPOUND: C18299
Entry
C18299                      Compound                               

Name
4-Aminoanhydrochlortetracycline;
4-Aminoanhydro-7-chlorotetracycline
Formula
C20H17ClN2O7
Exact mass
432.0724
Mol weight
432.8112
Structure
Reaction
Enzyme
2.1.1.-
Other DBs
PubChem: 103061481
ChEBI: 81650
KCF data

ATOM        30
            1   C8x C    11.7600  -15.5400
            2   C8x C    11.7600  -16.9400
            3   C8y C    12.9724  -17.6400
            4   C8y C    14.1849  -16.9400
            5   C8y C    14.1849  -15.5400
            6   C8y C    12.9724  -14.8400
            7   C8y C    15.3973  -17.6400
            8   C8y C    16.6097  -16.9400
            9   C8y C    16.6097  -15.5400
            10  C8y C    15.3973  -14.8400
            11  C5x C    17.8222  -17.6400
            12  C1z C    19.0346  -16.9400
            13  C1y C    19.0346  -15.5400
            14  C1x C    17.8222  -14.8400
            15  C5x C    20.2470  -17.6400
            16  C2y C    21.4595  -16.9400
            17  C2y C    21.4595  -15.5400
            18  C1y C    20.2470  -14.8400
            19  X   Cl   12.9724  -13.4402
            20  C1a C    15.3973  -13.4400
            21  O1a O    12.9724  -19.0398
            22  O1a O    15.3973  -19.0400
            23  O5x O    17.8222  -19.0397
            24  O5x O    20.2470  -19.0399
            25  C5a C    22.6946  -17.6534
            26  N1a N    23.9019  -16.9566
            27  O5a O    22.6942  -19.0399
            28  O1a O    22.6946  -14.8266
            29  N1a N    20.2470  -13.4401
            30  O1a O    19.0346  -18.3400
BOND        33
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    8  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16    9  14 1
            17   12  15 1
            18   15  16 1
            19   16  17 2
            20   17  18 1
            21   13  18 1
            22    6  19 1
            23   10  20 1
            24    3  21 1
            25    7  22 1
            26   11  23 2
            27   15  24 2
            28   16  25 1
            29   25  26 1
            30   25  27 2
            31   17  28 1
            32   18  29 1 #Down
            33   12  30 1 #Down

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