KEGG   DRUG: Monensin
Entry
D08228                      Drug                                   
Name
Monensin (INN);
Elancoban [veterinary] (TN)
Formula
C36H62O11
Exact mass
670.4292
Mol weight
670.8709
Structure
Simcomp
Sequence
0 Man  1 Mte  2 Mtd  3 Mae  4 Mtd  5 Ete  6 Mad  7 Mte  8 Man
9 Mak  10 Mtk  11 Mtk  12 Mtn
  Type
PK
Source
Streptomyces cinnamonensis [TAX:1900]
Remark
Same as: C06693
Chemical structure group: DG01221
Efficacy
Antibiotic, Antifungal, Antiprotozoal
Comment
See Monensin [DR:D05068]
Ionophore
Other DBs
CAS: 17090-79-8
PubChem: 96024916
ChEBI: 27617
LigandBox: D08228
NIKKAJI: J39.488B
KCF data

ATOM        47
            1   C1z C    14.0541  -15.1063
            2   O2x O    15.3830  -16.1554
            3   O2x O    13.3546  -16.2953
            4   C1x C    14.6836  -13.9173
            5   C1x C    13.3546  -13.9872
            6   C1z C    16.7119  -15.1063
            7   C1y C    12.0257  -16.2953
            8   C1x C    16.0125  -13.9173
            9   C1y C    12.0257  -13.9872
            10  C1y C    18.0408  -15.1063
            11  C1c C    11.3263  -17.4144
            12  C1y C    11.3263  -15.1063
            13  O1a O    11.3263  -12.7982
            14  O2x O    19.4397  -16.1554
            15  C1x C    18.7403  -13.9173
            16  C1c C     9.9974  -17.4144
            17  C1a C    11.9558  -18.6034
            18  C1a C     9.9974  -15.1063
            19  C1z C    20.7686  -15.1063
            20  C1x C    20.0692  -13.9173
            21  C1c C     9.2979  -18.6034
            22  O2a O     9.2979  -16.2953
            23  C1y C    22.0975  -15.1063
            24  C1b C    21.3981  -13.9173
            25  C6a C     7.9690  -18.6034
            26  C1a C     9.9974  -19.7925
            27  C1a C     7.9690  -16.2953
            28  O2x O    23.4265  -16.0855
            29  O6a O     7.2696  -19.7925
            30  O6a O     6.9898  -17.6242
            31  C1y C    24.7554  -15.1063
            32  C1x C    24.0559  -13.9173
            33  C1y C    26.0843  -15.1063
            34  O2x O    26.7837  -16.2254
            35  C1y C    26.7837  -13.9173
            36  C1z C    28.1126  -16.2253
            37  C1x C    28.1126  -13.9173
            38  C1a C    26.0843  -12.7982
            39  C1y C    28.8121  -15.1063
            40  C1b C    29.5115  -16.2254
            41  O1a O    28.1126  -17.6242
            42  C1a C    30.1410  -15.1063
            43  O1a O    30.2109  -17.4844
            44  C1a C    22.7270  -12.5883
            45  C1a C    16.7119  -16.6450
            46  C1y C    22.7970  -13.9173
            47  C1a C    20.6987  -12.7282
BOND        51
            1    10  14 1
            2    10  15 1
            3    11  16 1
            4    11  17 1 #Up
            5    12  18 1 #Down
            6    19  14 1
            7    15  20 1
            8    16  21 1
            9    16  22 1 #Down
            10   19  23 1
            11   19  24 1 #Down
            12   21  25 1
            13   21  26 1 #Down
            14   22  27 1
            15   23  28 1
            16   23  46 1
            17   25  29 1
            18   25  30 2
            19   28  31 1
            20   46  32 1
            21   31  33 1
            22   33  34 1
            23   33  35 1
            24   34  36 1
            25   35  37 1
            26   35  38 1 #Up
            27   36  39 1
            28   36  40 1 #Down
            29   36  41 1 #Up
            30   39  42 1 #Up
            31   40  43 1
            32    6   8 1
            33    9  12 1
            34   19  20 1
            35   31  32 1
            36   37  39 1
            37    1   2 1 #Up
            38    1   3 1
            39    1   4 1 #Down
            40    1   5 1
            41    6   2 1
            42   46  44 1 #Up
            43    7   3 1
            44    4   8 1
            45    5   9 1
            46    6  45 1 #Down
            47    6  10 1
            48    7  11 1
            49    7  12 1
            50    9  13 1 #Up
            51   24  47 1

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