KEGG   COMPOUND: C14839
Entry
C14839                      Compound                               

Name
Bromobenzene-3,4-oxide;
Bromobenzene-3,4-epoxide
Formula
C6H5BrO
Exact mass
171.9524
Mol weight
173.0073
Structure
Reaction
Pathway
map00980  Metabolism of xenobiotics by cytochrome P450
Enzyme
1.14.14.-       2.5.1.18        3.3.2.9
Other DBs
CAS: 51981-75-0
PubChem: 17395837
ChEBI: 34589
NIKKAJI: J578.529D
KCF data

ATOM        8
            1   C2x C    23.9396  -16.8520
            2   C2x C    23.9396  -18.2562
            3   C1y C    25.1557  -18.9583
            4   C1y C    26.3718  -18.2562
            5   C2x C    26.3718  -16.8520
            6   C2y C    25.1557  -16.1499
            7   X   Br   25.1557  -14.7458
            8   O2x O    26.3968  -19.6605
BOND        9
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     6   7 1
            8     3   8 1
            9     4   8 1

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