KEGG   COMPOUND: C13636Help
Entry
C13636                      Compound                               

Name
4-Hydroxyphenyl acetate
Formula
C8H8O3
Exact mass
152.0473
Mol weight
152.1473
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00363  Bisphenol degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
1.14.13.84      3.1.1.2
Other DBs
CAS: 3233-32-7
PubChem: 586252
ChEBI: 31128
ChEMBL: CHEMBL3039093
NIKKAJI: J83.249I
KCF data Show

ATOM        11
            1   C8x C    26.4208  -16.2786
            2   C8y C    26.4208  -17.6813
            3   C8x C    27.6394  -18.3792
            4   C8x C    28.8440  -17.6813
            5   C8y C    28.8440  -16.2786
            6   C8x C    27.6394  -15.5737
            7   O1a O    25.2052  -18.3799
            8   O7a O    30.0604  -15.5745
            9   C7a C    31.2692  -16.2722
            10  O6a O    31.2695  -17.6680
            11  C1a C    32.4778  -15.5742
BOND        11
            1     5   6 2
            2     6   1 1
            3     2   7 1
            4     1   2 2
            5     5   8 1
            6     2   3 1
            7     8   9 1
            8     3   4 2
            9     9  10 2
            10    4   5 1
            11    9  11 1

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