KEGG   COMPOUND: C04623Help
Entry
C04623                      Compound                               

Name
DDT;
1,1,1-Trichloro-2,2-bis(4-chlorophenyl)ethane;
1,1,1-Trichloro-2,2-bis-(4'-chlorophenyl)ethane;
Clofenotane;
Dichlorodiphenyltrichloroethane
Formula
C14H9Cl5
Exact mass
351.9147
Mol weight
354.4863
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Comment
organochlorine pesticide, insecticide
Persistent organic pollutant (POPs)
Reaction
Pathway
DDT degradation
Metabolic pathways
Microbial metabolism in diverse environments
Degradation of aromatic compounds
Enzyme
1.14.99.-       4.5.1.1
Brite
Endocrine disrupting compounds [BR:br08006]
 Pesticides and herbicides
  Organochlorine pesticides
   C04623  DDT
Pesticides [BR:br08007]
 Pesticides
  Insecticides
   Organochlorine insecticides
    C04623  DDT
Carcinogens [BR:br08008]
 Group 2B: Possibly carcinogenic to humans
  Compounds
   C04623  DDT
BRITE hierarchy
Other DBs
CAS: 
50-29-3
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        19
            1   C1c C    24.2704  -15.2349
            2   C8y C    23.0835  -15.9737
            3   C8y C    25.5591  -15.9303
            4   C8x C    21.8514  -15.3089
            5   C8x C    23.1237  -17.3601
            6   C8x C    25.5787  -17.3275
            7   C8x C    26.7449  -15.2202
            8   C8x C    20.6564  -16.0361
            9   C8x C    21.9368  -18.0989
            10  C8x C    26.7955  -18.0204
            11  C8x C    27.9739  -15.8906
            12  C8y C    20.6347  -17.4341
            13  C8y C    27.9936  -17.2878
            14  X   Cl   19.5180  -18.1729
            15  X   Cl   29.2195  -17.9638
            16  C1d C    24.2704  -13.8349
            17  X   Cl   24.2704  -12.4349
            18  X   Cl   25.6704  -13.8349
            19  X   Cl   22.8704  -13.8349
BOND        20
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 2
            5     3   6 1
            6     3   7 2
            7     4   8 2
            8     5   9 1
            9     6  10 2
            10    7  11 1
            11    8  12 1
            12   10  13 1
            13   12  14 1
            14   13  15 1
            15    9  12 2
            16   11  13 2
            17    1  16 1
            18   16  17 1
            19   16  18 1
            20   16  19 1

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