KEGG   COMPOUND: C11510
Entry
C11510                      Compound                               
Name
2,4.6-Trichloroanisole
Formula
C7H5Cl3O
Exact mass
209.9406
Mol weight
211.473
Structure
Reaction
R05754
Enzyme
2.1.1.136
Other DBs
CAS: 87-40-1
PubChem: 13680
ChEBI: 19333
NIKKAJI: J4.277C
LinkDB
KCF data

ATOM        11
            1   C8y C    26.7899  -19.1837
            2   C8x C    26.7899  -20.5833
            3   C8y C    28.0057  -21.2796
            4   C8x C    29.2145  -20.5833
            5   C8y C    29.2145  -19.1837
            6   C8y C    28.0057  -18.4804
            7   O2a O    28.0075  -17.0810
            8   X   Cl   30.4279  -18.4814
            9   X   Cl   25.5771  -18.4799
            10  X   Cl   28.0075  -22.6790
            11  C1a C    29.2213  -16.3862
BOND        11
            1     5   6 2
            2     6   1 1
            3     6   7 1
            4     1   2 2
            5     5   8 1
            6     2   3 1
            7     1   9 1
            8     3   4 2
            9     3  10 1
            10    4   5 1
            11    7  11 1

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