KEGG   COMPOUND: C11057
Entry
C11057                      Compound                               

Name
3,4,3',4'-Tetrachlorobiphenyl;
PCB 77
Formula
C12H6Cl4
Exact mass
289.9224
Mol weight
291.988
Structure
Pathway
map00621  Dioxin degradation
Brite
Endocrine disrupting compounds [BR:br08006]
 Dioxins and dioxin-like compounds
  Non-ortho (coplanar) PCBs
   C11057  3,4,3',4'-Tetrachlorobiphenyl (PCB 77)
Other DBs
CAS: 32598-13-3
PubChem: 13239
ChEBI: 1367
ChEMBL: CHEMBL344161
NIKKAJI: J70.045B
KCF data

ATOM        16
            1   C8y C    20.9002  -25.2748
            2   C8y C    20.1845  -26.4713
            3   C8x C    20.8654  -27.6979
            4   C8x C    22.2630  -27.7172
            5   C8y C    22.9856  -26.5136
            6   C8x C    22.3037  -25.2978
            7   C8y C    24.3868  -26.5362
            8   C8x C    25.0614  -27.7598
            9   C8x C    26.4624  -27.7824
            10  C8y C    27.1860  -26.5863
            11  C8y C    26.5014  -25.3607
            12  C8x C    25.1004  -25.3382
            13  X   Cl   20.2224  -24.0495
            14  X   Cl   18.7834  -26.4505
            15  X   Cl   27.2251  -24.1578
            16  X   Cl   28.5870  -26.6089
BOND        17
            1     2   3 1
            2     3   4 2
            3     4   5 1
            4     5   6 2
            5     7   8 2
            6     8   9 1
            7     9  10 2
            8    10  11 1
            9    11  12 2
            10   12   7 1
            11    6   1 1
            12    1  13 1
            13    2  14 1
            14    5   7 1
            15   11  15 1
            16    1   2 2
            17   10  16 1

» Japanese version

DBGET integrated database retrieval system