KEGG   COMPOUND: C18544
Entry
C18544                      Compound                               
Name
Simeconazole
Formula
C14H20FN3OSi
Exact mass
293.136
Mol weight
293.412
Structure
Brite
Pesticides [BR:br08007]
 Pesticides
  Fungicides
   Conazole fungicides
    C18544  Simeconazole
Other DBs
CAS: 149508-90-7
PubChem: 124489218
ChEBI: 81819
KCF data

ATOM        20
            1   C8y C    29.4710  -19.3843
            2   C8x C    29.4710  -20.7838
            3   C8x C    30.6829  -21.4835
            4   C8y C    31.8950  -20.7838
            5   C8x C    31.8950  -19.3843
            6   C8x C    30.6829  -18.6846
            7   X   F    33.1256  -21.4945
            8   C1d C    28.2590  -18.6846
            9   C1b C    27.0470  -19.3843
            10  N4y N    25.8350  -18.6846
            11  O1a O    27.0471  -17.9849
            12  C1b C    29.4710  -17.9849
            13  Z   Si   29.4711  -16.5854
            14  N5x N    25.6888  -17.2925
            15  C8x C    24.3196  -17.0014
            16  N5x N    23.6197  -18.2137
            17  C8x C    24.5563  -19.2539
            18  C1a C    30.8273  -15.7432
            19  C1a C    28.2599  -15.8861
            20  C1a C    30.8947  -17.3561
BOND        21
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     1   8 1
            9     8   9 1
            10    9  10 1
            11    8  11 1
            12    8  12 1
            13   12  13 1
            14   10  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   10  17 1
            19   13  18 1
            20   13  19 1
            21   13  20 1

» Japanese version

  All links  
Chemical substance (2)   
   PubChem (1)   
   ChEBI (1)   
All databases (2)   

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