KEGG   COMPOUND: C04596
Entry
C04596                      Compound                               
Name
1,1-Dichloro-2,2-bis(4-chlorophenyl)ethylene;
1,1-Dichloro-2,2-bis(4'-chlorophenyl)ethylene;
DDE
Formula
C14H8Cl4
Exact mass
315.938
Mol weight
318.0253
Structure
Reaction
Pathway
map00621  Dioxin degradation
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Enzyme
1.14.12.-       1.97.1.-        4.5.1.1
Brite
Endocrine disrupting compounds [BR:br08006]
 Pesticides and herbicides
  Organochlorine pesticides
   C04596  DDE
Other DBs
CAS: 72-55-9
PubChem: 7193
ChEBI: 16598
PDB-CCD: 6WS[PDBj]
3DMET: B00737
NIKKAJI: J2.817G
KCF data

ATOM        18
            1   C2c C    24.9200  -16.4283
            2   C8y C    26.1312  -17.1271
            3   C8y C    23.7029  -17.1271
            4   C2c C    24.9200  -15.0306
            5   C8x C    26.1312  -18.5248
            6   C8x C    27.3484  -16.4283
            7   C8x C    23.7029  -18.5248
            8   C8x C    22.4974  -16.4283
            9   X   Cl   26.1312  -14.3258
            10  X   Cl   23.7088  -14.3258
            11  C8x C    27.3484  -19.2294
            12  C8x C    28.5598  -17.1271
            13  C8x C    22.4974  -19.2294
            14  C8x C    21.2802  -17.1271
            15  C8y C    28.5598  -18.5248
            16  C8y C    21.2802  -18.5248
            17  X   Cl   29.7710  -19.2294
            18  X   Cl   20.0747  -19.2294
BOND        19
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     4  10 1
            10    5  11 1
            11    6  12 2
            12    7  13 2
            13    8  14 1
            14   11  15 2
            15   13  16 1
            16   15  17 1
            17   16  18 1
            18   12  15 1
            19   14  16 2

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