KEGG   COMPOUND: C14442Help
Entry
C14442                      Compound                               

Name
Fenitrothion;
O,O-Dimethyl O-(3-methyl-4-nitrophenyl) phosphorothioate;
MEP
Formula
C9H12NO5PS
Exact mass
277.0174
Mol weight
277.234
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Drug group: 
Brite
Pesticides [BR:br08007]
 Pesticides
  Insecticides
   Organophosphorus insecticides
    C14442  Fenitrothion
Target-based classification of compounds [BR:br08010]
 Enzymes
  Hydrolases
   ACHE; acetylcholinesterase
    C14442  Fenitrothion
Classification of Japanese OTC drugs [BR:br08313]
 Agents for sanitation
  82 Pesticides
   C14442  Fenitrothion
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Not used for human
   Insecticides
    C14442  Fenitrothion
Animal drugs in Japan [BR:br08331]
 99  Agents for not mainly purpose of therapeutic
  993  Insecticides and insect-repellents
   9932  Organic phosphorus and preparations
    C14442  Fenitrothion
BRITE hierarchy
Other DBs
CAS: 
122-14-5
PubChem: 
ChEBI: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        17
            1   P1a P    24.3294  -19.2313
            2   O2b O    25.5388  -18.5335
            3   S0  S    23.1365  -20.1499
            4   C8y C    25.5388  -17.1321
            5   C8x C    24.3237  -16.4283
            6   C8x C    26.7485  -16.4283
            7   C8x C    24.3237  -15.0328
            8   C8y C    26.7485  -15.0328
            9   C8y C    25.5388  -14.3350
            10  N2b N    25.5388  -12.9393 #+
            11  O3a O    24.3294  -12.0956
            12  O3a O    27.1043  -12.0256 #-
            13  C1a C    27.9810  -14.3208
            14  O2b O    25.2032  -20.3676
            15  C1a C    26.5876  -20.3938
            16  O2b O    23.3395  -18.2414
            17  C1a C    21.9525  -18.2624
BOND        17
            1     1   2 1
            2     1   3 2
            3     2   4 1
            4     4   5 1
            5     4   6 2
            6     5   7 2
            7     6   8 1
            8     7   9 1
            9     9  10 1
            10   10  11 2
            11   10  12 1
            12    8   9 2
            13    8  13 1
            14    1  14 1
            15   14  15 1
            16    1  16 1
            17   16  17 1

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