KEGG   COMPOUND: C06670
Entry
C06670                      Compound                               
Name
2,4-Dichlorobenzoate;
2,4-Dichlorobenzoic acid
Formula
C7H4Cl2O2
Exact mass
189.9588
Mol weight
191.0115
Structure
Reaction
R05451
Pathway
map00364  Fluorobenzoate degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
6.2.1.-
Other DBs
CAS: 50-84-0
PubChem: 8895
ChEBI: 30748
KNApSAcK: C00042066
3DMET: B01020
NIKKAJI: J55.459F
LinkDB
KCF data

ATOM        11
            1   C8y C    28.2687  -15.8850
            2   C8y C    29.4803  -16.5840
            3   C8x C    27.0512  -16.5840
            4   C6a C    28.2744  -14.4871
            5   C8x C    29.4803  -17.9821
            6   X   Cl   30.6861  -15.8850
            7   C8x C    27.0512  -17.9821
            8   O6a O    27.0570  -13.7821
            9   O6a O    29.4862  -13.7821
            10  C8y C    28.2687  -18.6870
            11  X   Cl   28.2744  -20.0792
BOND        11
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     4   8 1
            8     4   9 2
            9     5  10 2
            10   10  11 1
            11    7  10 1

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