KEGG   COMPOUND: C04382
Entry
C04382                      Compound                               
Name
Dihydrostreptomycin 3'alpha-phosphate
Formula
C21H42N7O15P
Exact mass
663.2477
Mol weight
663.5698
Structure
Other DBs
PubChem: 7023
ChEBI: 28703
NIKKAJI: J2.750.353E
LinkDB
KCF data

ATOM        44
            1   C1y C    28.0720  -20.9064
            2   C1y C    28.4803  -19.6572
            3   C1z C    26.7624  -20.9064
            4   O2a O    29.7476  -22.0058
            5   O2a O    30.0120  -18.2997
            6   O2x O    27.4113  -18.8944
            7   C1y C    26.3662  -19.6572
            8   C1b C    25.4593  -21.6333
            9   C1y C    28.6665  -24.0778
            10  C1y C    29.9819  -16.6779
            11  C1a C    25.1228  -19.2487
            12  O2b O    24.3359  -20.9665
            13  C1y C    28.6665  -25.3991
            14  O2x O    27.5192  -23.4233
            15  C1y C    28.8526  -16.0113
            16  C1y C    31.1291  -16.0113
            17  C1y C    27.5192  -26.0659
            18  C1y C    26.3901  -24.0778
            19  C1y C    28.8526  -14.6899
            20  N1b N    27.0269  -16.8280
            21  C1y C    31.1291  -14.6899
            22  O1a O    32.2583  -16.6600
            23  C1y C    26.3901  -25.3991
            24  O1a O    27.5192  -27.3753
            25  C1b C    25.2610  -23.4233
            26  C1y C    29.9819  -14.0351
            27  O1a O    27.9384  -13.9589
            28  C2c C    25.8976  -16.1734
            29  O1a O    32.2583  -14.0292
            30  O1a O    25.2548  -26.0480
            31  O1a O    24.1257  -24.0778
            32  N1b N    29.9759  -12.7258
            33  N1a N    24.7625  -16.8220
            34  N2a N    25.9036  -14.8642
            35  C2c C    28.8468  -12.0771
            36  N2a N    28.8407  -10.7738
            37  N1a N    27.7175  -12.7318
            38  N1b N    29.8708  -26.0922
            39  C1a C    31.0774  -25.3930
            40  P1b P    22.9359  -20.9665
            41  O1c O    22.9359  -19.5664
            42  O1c O    21.5359  -20.9665
            43  O1c O    22.9359  -22.3665
            44  O1a O    26.7624  -22.3064
BOND        46
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1 #Up
            5     2   6 1
            6     3   7 1
            7     3   8 1 #Up
            8     9   4 1 #Up
            9    10   5 1 #Down
            10    7  11 1 #Down
            11    8  12 1
            12    9  13 1
            13    9  14 1
            14   10  15 1
            15   10  16 1
            16   13  17 1
            17   14  18 1
            18   15  19 1
            19   15  20 1 #Up
            20   16  21 1
            21   16  22 1 #Up
            22   17  23 1
            23   17  24 1 #Down
            24   18  25 1 #Down
            25   19  26 1
            26   19  27 1 #Down
            27   20  28 1
            28   21  29 1 #Down
            29   23  30 1 #Up
            30   25  31 1
            31   26  32 1 #Up
            32   28  33 1
            33   28  34 2
            34   32  35 1
            35   35  36 2
            36   35  37 1
            37    6   7 1
            38   18  23 1
            39   21  26 1
            40   13  38 1 #Up
            41   38  39 1
            42   12  40 1
            43   40  41 2
            44   40  42 1
            45   40  43 1
            46    3  44 1

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