KEGG   COMPOUND: C17588Help
Entry
C17588                      Compound                               

Name
6'''-Deamino-6'''-hydroxyneomycin C;
6'''-Hydroxyneomycin C;
Neomycin Y2
Formula
C23H45N5O14
Exact mass
615.2963
Mol weight
615.6285
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00524  Neomycin, kanamycin and gentamicin biosynthesis
map01130  Biosynthesis of antibiotics
Enzyme
1.1.3.44        3.5.1.113
Other DBs
PubChem: 96023933
ChEBI: 65043
KCF data Show

ATOM        42
            1   O1a O    28.7310  -19.9051
            2   C1y C    29.9224  -19.2043
            3   C1y C    31.1838  -19.9752
            4   C1x C    32.3752  -19.2744
            5   C1y C    32.3752  -17.8728
            6   C1y C    31.1838  -17.1720
            7   C1y C    29.9224  -17.8728
            8   N1a N    31.1838  -21.3768
            9   O2a O    28.7310  -17.1720
            10  N1a N    33.6367  -17.1720
            11  O2a O    31.1838  -15.7703
            12  C1y C    32.3752  -15.0695
            13  O2x O    33.5666  -15.7703
            14  C1y C    34.7580  -15.0695
            15  C1y C    34.7580  -13.6679
            16  C1y C    33.5666  -12.9671
            17  C1y C    32.3752  -13.6679
            18  C1b C    36.0194  -15.7703
            19  N1a N    31.1138  -12.9671
            20  O1a O    33.5666  -11.5655
            21  O1a O    35.9494  -12.9671
            22  N1a N    36.0194  -17.1720
            23  C1y C    25.5072  -18.9240
            24  C1y C    26.9089  -18.9240
            25  C1y C    27.3294  -17.5924
            26  O2x O    26.2081  -16.7515
            27  C1y C    25.0868  -17.5924
            28  C1b C    23.7552  -17.1720
            29  O1a O    22.7040  -18.0830
            30  O2a O    24.6663  -20.0453
            31  O1a O    27.7499  -20.0453
            32  C1y C    21.0220  -20.7461
            33  C1y C    21.0220  -22.1477
            34  C1y C    22.2134  -22.8486
            35  C1y C    23.4749  -22.1477
            36  C1y C    23.4749  -20.7461
            37  O2x O    22.2134  -20.0453
            38  N1a N    24.6663  -22.8486
            39  O1a O    19.8307  -22.8486
            40  O1a O    22.2134  -24.2502
            41  C1b C    19.8307  -20.0453
            42  O1a O    18.6393  -20.7461
BOND        45
            1     2   1 1 #Down
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     2   7 1
            8     3   8 1 #Up
            9     7   9 1 #Up
            10    5  10 1 #Up
            11    6  11 1 #Down
            12   12  11 1 #Down
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   12  17 1
            19   14  18 1 #Up
            20   17  19 1 #Down
            21   16  20 1 #Up
            22   15  21 1 #Down
            23   18  22 1
            24   23  24 1
            25   24  25 1
            26   25  26 1
            27   26  27 1
            28   23  27 1
            29   27  28 1 #Up
            30   28  29 1
            31   23  30 1 #Down
            32   24  31 1 #Down
            33   25   9 1 #Up
            34   32  33 1
            35   33  34 1
            36   34  35 1
            37   35  36 1
            38   36  37 1
            39   32  37 1
            40   36  30 1 #Down
            41   35  38 1 #Down
            42   33  39 1 #Down
            43   34  40 1 #Up
            44   32  41 1 #Up
            45   41  42 1

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