KEGG   COMPOUND: C13635
Entry
C13635                      Compound                               
Name
4-Hydroxyphenacyl alcohol;
2,4'-Dihydroxyacetophenone
Formula
C8H8O3
Exact mass
152.0473
Mol weight
152.15
Structure
Reaction
R01305 R06889
Pathway
map00363  Bisphenol degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.13.11.41      1.13.-.-
Other DBs
CAS: 5706-85-4
PubChem: 586251
ChEBI: 35164
NIKKAJI: J81.083E
LinkDB
KCF data

ATOM        11
            1   C8x C    27.0626  -17.3134
            2   C8y C    27.0626  -18.7140
            3   C8x C    28.2796  -19.4179
            4   C8x C    29.4824  -18.7140
            5   C8y C    29.4824  -17.3134
            6   C8x C    28.2796  -16.6165
            7   O1a O    25.8490  -19.4186
            8   C5a C    30.6824  -16.5900
            9   C1b C    31.8949  -17.2900
            10  O1a O    33.1073  -16.5900
            11  O5a O    30.6692  -15.1900
BOND        11
            1     5   6 2
            2     6   1 1
            3     2   7 1
            4     1   2 2
            5     2   3 1
            6     3   4 2
            7     4   5 1
            8     5   8 1
            9     8   9 1
            10    9  10 1
            11    8  11 2

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