KEGG   COMPOUND: C14388Help
Entry
C14388                      Compound                               

Name
Permethrin
Formula
C21H20Cl2O3
Exact mass
390.079
Mol weight
391.2877
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Brite
Endocrine disrupting compounds [BR:br08006]
 Pesticides and herbicides
  Pyrethroid pesticides
   C14388  Permethrin
Pesticides [BR:br08007]
 Pesticides
  Insecticides
   Pyrethroid insecticides
    C14388  Permethrin
Carcinogens [BR:br08008]
 Group 3: Not classifiable as to its carcinogenicity to humans
  Compounds
   C14388  Permethrin
Target-based classification of compounds [BR:br08010]
 Ion channels
  Voltage-gated cation channels
   Na+ channel, SCN alpha, NaV1.x
    voltage-gated sodium channel
     C14388  Permethrin
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 P ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
  P03 ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
   P03A ECTOPARASITICIDES, INCL. SCABICIDES
    P03AC Pyrethrines, incl. synthetic compounds
     P03AC04 Permethrin
      D05443  Permethrin (USAN/INN)
USP drug classification [BR:br08302]
 Antiparasitics
  Pediculicides/Scabicides
   Permethrin
    D05443  Permethrin (USAN/INN)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for sanitation
  82 Pesticides
   D05443  Permethrin (USAN/INN)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Not used for human
   Insecticides
    D05443  Permethrin (USAN/INN)
Phytochemicals used as drugs [BR:br08306]
 Terpenoids
  Monoterpenoids (C10)
   D05443  Permethrin (USAN/INN)
Animal drugs in Japan [BR:br08331]
 99  Agents for not mainly purpose of therapeutic
  993  Insecticides and insect-repellents
   9931  Pyrethrum and preparations (including synthetic)
    C14388  Permethrin
BRITE hierarchy
Other DBs
CAS: 
52645-53-1
PubChem: 
ChEBI: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        26
            1   C1y C    17.3217  -17.8959
            2   C1y C    15.9187  -17.9076
            3   C1z C    16.6145  -16.6800
            4   C7a C    18.5319  -17.1944
            5   C2b C    14.7086  -17.2001
            6   C1a C    15.9070  -15.4640
            7   C1a C    17.3100  -15.4640
            8   O7a O    19.7361  -17.8959
            9   O6a O    18.5319  -15.7971
            10  C2c C    13.4985  -17.9017
            11  X   Cl   12.2944  -17.2001
            12  X   Cl   13.4985  -19.2987
            13  C1b C    20.9442  -17.2048
            14  C8y C    22.1506  -17.9077
            15  C8x C    22.1452  -19.3203
            16  C8x C    23.3550  -20.0249
            17  C8x C    24.5701  -19.3295
            18  C8y C    24.5755  -17.9170
            19  C8x C    23.3656  -17.2123
            20  O2a O    25.7857  -17.2244
            21  C8y C    26.9753  -17.9173
            22  C8x C    26.9699  -19.3204
            23  C8x C    28.1796  -20.0251
            24  C8x C    29.3948  -19.3298
            25  C8x C    29.4003  -17.9267
            26  C8x C    28.1904  -17.2220
BOND        28
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     3   7 1
            7     4   8 1
            8     4   9 2
            9     5  10 2
            10   10  11 1
            11   10  12 1
            12    2   3 1
            13    8  13 1
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   17  18 1
            19   18  19 2
            20   14  19 1
            21   18  20 1
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 2
            26   24  25 1
            27   25  26 2
            28   21  26 1

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