KEGG   COMPOUND: C18270Help
Entry
C18270                      Compound                               

Name
Benzo[a]pyrene-cis-4,5-dihydrodiol
Formula
C20H14O2
Exact mass
286.0994
Mol weight
286.324
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00624  Polycyclic aromatic hydrocarbon degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.3.-.-         1.14.12.-
Other DBs
PubChem: 103061452
ChEBI: 81621
LinkDB All DBs
KCF data Show

ATOM        22
            1   C8y C    27.2089  -18.6555
            2   C8y C    28.4011  -17.9541
            3   C8y C    26.0165  -17.9541
            4   C8y C    27.2089  -20.0581
            5   C8y C    28.4011  -16.5516
            6   C8y C    29.6634  -18.6555
            7   C8y C    24.8242  -18.6555
            8   C8x C    26.0165  -16.5516
            9   C8x C    26.0165  -20.7594
            10  C1y C    28.4011  -20.7594
            11  C8x C    27.2089  -15.8502
            12  C8x C    29.6634  -15.8502
            13  C1y C    29.6634  -20.0581
            14  C8x C    30.8556  -17.9541
            15  C8y C    24.8242  -20.0581
            16  C8x C    23.5619  -17.9541
            17  C8x C    30.8556  -16.5516
            18  C8x C    23.6320  -20.7594
            19  C8x C    22.3697  -18.6555
            20  C8x C    22.3697  -20.0581
            21  O1a O    28.3838  -22.1455
            22  O1a O    30.8498  -20.7561
BOND        26
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     4  10 1
            10    5  11 1
            11    5  12 2
            12    6  13 1
            13    6  14 1
            14    7  15 2
            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 1
            22   10  13 1
            23   14  17 2
            24   19  20 1
            25   10  21 1 #Up
            26   13  22 1 #Up

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