KEGG   COMPOUND: C19389Help
Entry
C19389                      Compound                               

Name
Dibenz[a,j]anthracene;
Dibenzo-1,2,7,8-anthracene
Formula
C22H14
Exact mass
278.1096
Mol weight
278.3466
Structure
Mol fileKCF fileDB search
Brite
Carcinogens [BR:br08008]
 Group 3: Not classifiable as to its carcinogenicity to humans
  Compounds
   C19389  Dibenz[a,j]anthracene
BRITE hierarchy
Other DBs
CAS: 224-41-9
PubChem: 124490061
ChEBI: 82438
ChEMBL: CHEMBL24775
LinkDB All DBs
KCF data Show

ATOM        22
            1   C8y C    20.0200  -19.6700
            2   C8x C    20.0200  -21.0700
            3   C8x C    21.2324  -21.7700
            4   C8y C    22.4449  -21.0700
            5   C8y C    22.4449  -19.6700
            6   C8y C    21.2324  -18.9700
            7   C8x C    23.6573  -21.7700
            8   C8y C    24.8697  -21.0700
            9   C8y C    24.8697  -19.6700
            10  C8x C    23.6573  -18.9700
            11  C8x C    26.0822  -21.7700
            12  C8x C    27.2946  -21.0700
            13  C8y C    27.2946  -19.6700
            14  C8y C    26.0822  -18.9700
            15  C8x C    21.2324  -17.5700
            16  C8x C    20.0200  -16.8700
            17  C8x C    18.8076  -17.5700
            18  C8x C    18.8076  -18.9700
            19  C8x C    28.5070  -18.9700
            20  C8x C    28.5070  -17.5700
            21  C8x C    27.2946  -16.8700
            22  C8x C    26.0822  -17.5700
BOND        26
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    8  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16    9  14 1
            17    6  15 1
            18   15  16 2
            19   16  17 1
            20   17  18 2
            21    1  18 1
            22   13  19 1
            23   19  20 2
            24   20  21 1
            25   21  22 2
            26   14  22 1

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