KEGG   COMPOUND: C21895
Entry
C21895                      Compound                               
Name
2-Acetylphloroglucinol;
Monoacetylphloroglucinol
Formula
C8H8O4
Exact mass
168.0423
Mol weight
168.1467
Structure
Reaction
R12087 R12392
Enzyme
2.3.1.272       3.7.1.24
Other DBs
CAS: 480-66-0
PDB-CCD: 83X[PDBj]
LinkDB
KCF data

ATOM        12
            1   C8y C    17.4104  -17.5738
            2   C8x C    17.4104  -16.1660
            3   C8x C    18.6136  -18.2843
            4   O1a O    16.2007  -18.2650
            5   C8y C    18.6136  -15.4683
            6   C8y C    19.8358  -17.5738
            7   C8y C    19.8358  -16.1660
            8   O1a O    18.6136  -14.0795
            9   O1a O    21.0453  -18.2650
            10  C5a C    21.0254  -15.4751
            11  C1a C    22.2182  -16.1599
            12  O5a O    21.0219  -14.0702
BOND        12
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     5   7 1
            7     5   8 1
            8     6   9 1
            9     6   7 2
            10    7  10 1
            11   10  11 1
            12   10  12 2

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