KEGG   DRUG: CyhalothrinHelp
Entry
D07762                      Drug                                   

Name
Cyhalothrin (BAN);
Coopertix [veterinary] (TN)
Formula
C23H19ClF3NO3
Exact mass
449.1006
Mol weight
449.8501
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Same as: C10983
Efficacy
Insecticide
Comment
Pyrethroid (pyrethrin derivative)
Other DBs
CAS: 68085-85-8
PubChem: 51092054
ChEBI: 4035
ChEMBL: CHEMBL2105498
LigandBox: D07762
NIKKAJI: J18.747J
LinkDB All DBs
KCF data Show

ATOM        31
            1   C1y C    14.2597  -16.8509
            2   C1y C    15.6583  -16.8509
            3   C1z C    14.9590  -15.5922
            4   C1a C    15.6583  -14.4034
            5   C1a C    14.0500  -14.4732
            6   C2b C    13.0709  -16.1516
            7   C2c C    11.8821  -16.8509
            8   C1d C    10.6234  -16.1516
            9   X   Cl   11.8821  -18.2495
            10  X   F     9.4346  -16.8509
            11  X   F    10.6234  -14.7531
            12  X   F     9.4346  -15.4523
            13  C8y C    25.3084  -16.8509
            14  C8x C    25.3084  -18.2495
            15  C8x C    26.5671  -18.9488
            16  C8x C    27.7558  -18.2495
            17  C8x C    27.7558  -16.8509
            18  C8x C    26.5671  -16.1516
            19  C8y C    20.4833  -16.8509
            20  C8x C    20.4833  -18.2495
            21  C8x C    21.7420  -18.9488
            22  C8x C    22.9308  -18.2495
            23  C8y C    22.9308  -16.8509
            24  C8x C    21.7420  -16.1516
            25  O2a O    24.1196  -16.1516
            26  C1c C    19.2945  -16.1516
            27  O7a O    18.1057  -16.8509
            28  C7a C    16.9170  -16.1516
            29  O6a O    16.9170  -14.8231
            30  C3b C    19.2945  -14.7531
            31  N3a N    19.2945  -13.3545
BOND        33
            1    13  14 2
            2    14  15 1
            3    15  16 2
            4    16  17 1
            5    17  18 2
            6    18  13 1
            7     7   9 1
            8     1   2 1
            9     8  10 1
            10    3   5 1
            11    8  11 1
            12    1   3 1
            13   19  20 2
            14   20  21 1
            15   21  22 2
            16   22  23 1
            17   23  24 2
            18   24  19 1
            19    8  12 1
            20   23  25 1
            21   25  13 1
            22    1   6 1
            23   19  26 1
            24    3   2 1
            25   26  27 1
            26    6   7 2
            27   27  28 1
            28   28   2 1
            29   28  29 2
            30    7   8 1
            31   26  30 1
            32    3   4 1
            33   30  31 3

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