KEGG   COMPOUND: C01273
Entry
C01273                      Compound                               
Name
2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate;
2,6-Dioxo-6-phenylhexa-3-enoate
Formula
C12H10O4
Exact mass
218.0579
Mol weight
218.2054
Structure
Reaction
Pathway
map00621  Dioxin degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Module
M00543  Biphenyl degradation, biphenyl => 2-oxopent-4-enoate + benzoate
Enzyme
1.3.1.40        1.13.11.39      3.7.1.8
Other DBs
PubChem: 4492
ChEBI: 17820
3DMET: B00271
NIKKAJI: J922.501C
LinkDB
KCF data

ATOM        16
            1   C8y C    27.0841  -17.2959
            2   C5a C    28.3967  -16.7183
            3   C8x C    25.8939  -16.5491
            4   C8x C    27.0841  -18.6843
            5   C2b C    28.3908  -15.2424
            6   O5a O    29.5110  -17.4009
            7   C8x C    24.6456  -17.1791
            8   C8x C    25.7774  -19.3494
            9   C2b C    29.6275  -14.6007
            10  C8x C    24.6631  -18.5909
            11  C2b C    30.8060  -15.3532
            12  C2c C    30.8117  -16.7474
            13  C6a C    31.9202  -17.5001
            14  O1a O    32.0894  -15.8899
            15  O6a O    31.9261  -18.8943
            16  O6a O    33.1569  -16.8584
BOND        16
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 2
            6     3   7 2
            7     4   8 1
            8     5   9 2
            9     7  10 1
            10    9  11 1
            11   11  12 2
            12   12  13 1
            13   12  14 1
            14   13  15 1
            15   13  16 2
            16    8  10 2

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