KEGG   COMPOUND: C07535Help
Entry
C07535                      Compound                               

Name
Benzo[a]pyrene;
Benzpyrene
Formula
C20H12
Exact mass
252.0939
Mol weight
252.3093
Structure
Mol fileKCF fileDB searchJmolKegDraw
Comment
carcinogenic
IARC Group 1
Reaction
Pathway
Polycyclic aromatic hydrocarbon degradation
Metabolism of xenobiotics by cytochrome P450
Microbial metabolism in diverse environments
Chemical carcinogenesis
Enzyme
1.14.12.12      1.14.12.-       1.14.13.-       1.14.14.1       
1.14.-.-
Brite
Carcinogens [BR:br08008]
 Group 1: Carcinogenic to humans
  Compounds
   C07535  Benzo[a]pyrene
BRITE hierarchy
Other DBs
CAS: 
50-32-8
PubChem: 
ChEBI: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        20
            1   C8y C    24.0100  -18.1300
            2   C8y C    25.2000  -17.4300
            3   C8y C    22.8200  -17.4300
            4   C8y C    24.0100  -19.5300
            5   C8y C    25.2000  -16.0300
            6   C8y C    26.4600  -18.1300
            7   C8y C    21.6300  -18.1300
            8   C8x C    22.8200  -16.0300
            9   C8x C    22.8200  -20.2300
            10  C8x C    25.2000  -20.2300
            11  C8x C    24.0100  -15.3300
            12  C8x C    26.4600  -15.3300
            13  C8x C    26.4600  -19.5300
            14  C8x C    27.6500  -17.4300
            15  C8y C    21.6300  -19.5300
            16  C8x C    20.3700  -17.4300
            17  C8x C    27.6500  -16.0300
            18  C8x C    20.4400  -20.2300
            19  C8x C    19.1800  -18.1300
            20  C8x C    19.1800  -19.5300
BOND        24
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     4  10 2
            10    5  11 1
            11    5  12 2
            12    6  13 2
            13    6  14 1
            14    7  15 1
            15    7  16 1
            16   12  17 1
            17   15  18 1
            18   16  19 2
            19   18  20 2
            20    8  11 2
            21    9  15 2
            22   10  13 1
            23   14  17 2
            24   19  20 1

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