KEGG   COMPOUND: C06670Help
Entry
C06670                      Compound                               

Name
2,4-Dichlorobenzoate;
2,4-Dichlorobenzoic acid
Formula
C7H4Cl2O2
Exact mass
189.9588
Mol weight
191.0115
Structure
Mol fileKCF fileDB search
Reaction
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
ChEMBL: CHEMBL1492029
KNApSAcK: C00042066
3DMET: B01020
NIKKAJI: J55.459F
LinkDB All DBs
KCF data Show

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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