KEGG   COMPOUND: C04596Help
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
Mol fileKCF fileDB search
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
BRITE hierarchy
Other DBs
CAS: 72-55-9
PubChem: 7193
ChEBI: 16598
ChEMBL: CHEMBL363207
PDB-CCD: 6WS[PDBj]
3DMET: B00737
NIKKAJI: J2.817G
LinkDB All DBs
KCF data Show

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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