KEGG   COMPOUND: C14435Help
Entry
C14435                      Compound                               

Name
Benzo[e]pyrene;
1,2-Benzpyrene
Formula
C20H12
Exact mass
252.0939
Mol weight
252.3093
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Carcinogens [BR:br08008]
 Group 3: Not classifiable as to its carcinogenicity to humans
  Compounds
   C14435  Benzo[e]pyrene
BRITE hierarchy
Other DBs
CAS: 
192-97-2
PubChem: 
ChEBI: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        20
            1   C8x C    25.8300  -18.3400
            2   C8x C    25.8300  -19.7400
            3   C8x C    27.0424  -20.4400
            4   C8y C    28.2549  -19.7400
            5   C8y C    28.2549  -18.3400
            6   C8y C    27.0424  -17.6400
            7   C8y C    29.4673  -17.6400
            8   C8y C    29.4673  -16.2400
            9   C8y C    28.2549  -15.5400
            10  C8y C    27.0424  -16.2400
            11  C8x C    29.4673  -20.4400
            12  C8x C    30.6797  -19.7400
            13  C8y C    30.6797  -18.3400
            14  C8x C    31.8922  -17.6400
            15  C8x C    31.8922  -16.2400
            16  C8x C    30.6797  -15.5400
            17  C8x C    28.2549  -14.1400
            18  C8x C    27.0425  -13.4400
            19  C8x C    25.8300  -14.1400
            20  C8x C    25.8300  -15.5400
BOND        24
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     5   7 2
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    6  10 2
            12    4  11 1
            13   11  12 2
            14   12  13 1
            15    7  13 1
            16   13  14 2
            17   14  15 1
            18   15  16 2
            19    8  16 1
            20    9  17 1
            21   17  18 2
            22   18  19 1
            23   19  20 2
            24   10  20 1

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