KEGG   DRUG: DeltamethrinHelp
Entry
D07785                      Drug                                   

Name
Deltamethrin (BAN);
Decamethrin;
Scalibor [veterinary] (TN)
Formula
C22H19Br2NO3
Exact mass
502.9732
Mol weight
505.1992
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Remark
Same as: 
ATC code: 
Efficacy
Insecticide, Pediculicide
Comment
Pyrethroid (pyrethrin derivative)
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 P ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
  P03 ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
   P03B INSECTICIDES AND REPELLENTS
    P03BA Pyrethrines
     P03BA03 Decamethrin
      D07785  Deltamethrin (BAN)
BRITE hierarchy
Other DBs
CAS: 
52918-63-5
PubChem: 
ChEBI: 
ChEMBL: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        28
            1   C8y C    30.2400  -18.6200
            2   C8x C    30.2400  -20.0900
            3   C8x C    31.4300  -20.7900
            4   C8x C    32.6200  -20.0900
            5   C8x C    32.6200  -18.6200
            6   C8x C    31.4300  -17.9200
            7   C8y C    25.4800  -18.6200
            8   C8x C    25.4800  -20.0900
            9   C8x C    26.6700  -20.7900
            10  C8x C    27.8600  -20.0900
            11  C8y C    27.8600  -18.6200
            12  C8x C    26.6700  -17.9200
            13  O2a O    29.0500  -17.9200
            14  C1c C    24.2900  -17.9200
            15  O7a O    23.1000  -18.6200
            16  C7a C    21.9100  -17.9200
            17  O6a O    21.9100  -16.5200
            18  C3b C    24.2900  -16.5200
            19  N3a N    24.2900  -15.0500
            20  C1y C    20.7200  -18.6200
            21  C1y C    19.3200  -18.6200
            22  C1z C    20.0200  -17.3600
            23  C2b C    18.1300  -17.9200
            24  C2c C    16.9400  -18.6200
            25  X   Br   15.7500  -17.9200
            26  X   Br   16.9400  -20.0900
            27  C1a C    20.7200  -16.1700
            28  C1a C    19.0400  -16.3800
BOND        30
            1     7  14 1
            2     1   2 2
            3    14  15 1
            4     2   3 1
            5    15  16 1
            6     3   4 2
            7    16  17 2
            8     4   5 1
            9    14  18 1 #Down
            10    5   6 2
            11   18  19 3
            12    7   8 2
            13   20  16 1 #Down
            14    8   9 1
            15    9  10 2
            16   20  21 1
            17   20  22 1
            18   22  21 1
            19   10  11 1
            20   11  12 2
            21   23  24 2
            22   12   7 1
            23   24  25 1
            24    6   1 1
            25   24  26 1
            26   21  23 1 #Down
            27   11  13 1
            28   22  27 1
            29   13   1 1
            30   22  28 1

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