KEGG   COMPOUND: C11121Help
Entry
C11121                      Compound                               

Name
Propiconazole
Formula
C15H17Cl2N3O2
Exact mass
341.0698
Mol weight
342.2204
Structure
Mol fileKCF fileDB search
Brite
Pesticides [BR:br08007]
 Pesticides
  Fungicides
   Conazole fungicides
    C11121  Propiconazole
BRITE hierarchy
Other DBs
CAS: 60207-90-1
PubChem: 13303
ChEBI: 8489
ChEMBL: CHEMBL560579
NIKKAJI: J18.426H
LinkDB All DBs
KCF data Show

ATOM        22
            1   C8y C    37.1700  -30.1000
            2   C8y C    37.1700  -31.5000
            3   C8x C    38.3824  -32.2000
            4   C8y C    39.5949  -31.5000
            5   C8x C    39.5949  -30.1000
            6   C8x C    38.3824  -29.4000
            7   C1z C    35.9576  -29.4012
            8   C1b C    34.7621  -30.0904
            9   O2x O    37.1300  -28.6359
            10  C1x C    36.7644  -27.2145
            11  C1y C    35.3661  -27.2145
            12  O2x O    34.8675  -28.5228
            13  C1b C    34.5738  -26.0648
            14  C1b C    33.1866  -26.1756
            15  C1a C    32.3922  -25.0227
            16  N4y N    33.5753  -29.4040
            17  N5x N    33.4298  -28.0104
            18  C8x C    32.0595  -27.7180
            19  N5x N    31.3580  -28.9310
            20  C8x C    32.2948  -29.9730
            21  X   Cl   35.9576  -32.2000
            22  X   Cl   40.8260  -32.2110
BOND        24
            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     1   7 1
            8     7   8 1
            9     7   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13    7  12 1
            14   11  13 1
            15   13  14 1
            16   14  15 1
            17    8  16 1
            18   16  17 1
            19   17  18 2
            20   18  19 1
            21   19  20 2
            22   16  20 1
            23    2  21 1
            24    4  22 1

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