KEGG   COMPOUND: C11028Help
Entry
C11028                      Compound                               
Name
Phosalone;
Agria 1060 A
Formula
C12H15ClNO4PS2
Exact mass
366.9869
Mol weight
367.8086
Structure
Mol fileKCF fileDB searchJmolKegDraw
Comment
organophosphorus insecticide
Target: acetylcholinesterase (AChE) inhibitor [KO:K01049]
Brite
Pesticides [BR:br08007]
 Pesticides
  Insecticides
   Organophosphorus insecticides
    C11028  Phosalone
BRITE hierarchy
Other DBs
CAS: 
2310-17-0
PubChem: 
ChEBI: 
NIKKAJI: 
KCF data Show

ATOM        21
            1   C8x C    25.0084  -26.2827
            2   C8y C    25.0084  -27.6855
            3   C8x C    26.2270  -28.3834
            4   C8x C    26.2270  -25.5779
            5   C8y C    27.4387  -26.2827
            6   C8y C    27.4328  -27.6889
            7   O7x O    28.7688  -28.1269
            8   C8y C    29.5958  -26.9914
            9   N4y N    28.7781  -25.8560
            10  X   Cl   23.7888  -28.3763
            11  O6a O    30.9932  -26.9876
            12  C1b C    28.7727  -24.4570
            13  S2a S    29.9851  -23.7520
            14  P1a P    31.1976  -24.4499
            15  O2b O    32.4030  -23.7449
            16  S0  S    29.9781  -25.1407
            17  O2b O    31.1976  -25.8457
            18  C1b C    32.4030  -26.5364
            19  C1a C    33.6155  -25.8316
            20  C1b C    32.4030  -22.3492
            21  C1a C    31.1976  -21.6584
BOND        22
            1     2  10 1
            2     8  11 2
            3     1   2 1
            4     9  12 1
            5     2   3 2
            6    12  13 1
            7     3   6 1
            8    13  14 1
            9     5   4 1
            10   14  15 1
            11    5   6 2
            12   14  16 2
            13    6   7 1
            14   14  17 1
            15    7   8 1
            16   17  18 1
            17    8   9 1
            18   18  19 1
            19    9   5 1
            20   15  20 1
            21    4   1 2
            22   20  21 1

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