COMPOUND: C20685
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Entry
C20685 Compound
Name
(R)-(2,4-Dichlorophenoxy)propanoate;
(R)-Dichlorprop
Formula
C9H8Cl2O3
Exact mass
233.9850
Mol weight
235.06
Structure
Mol file
KCF file
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Reaction
R10542
Enzyme
1.14.11.44
Other DBs
PubChem:
172232405
PDB-CCD:
FTV
[
PDBj
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KCF data
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ATOM 14
1 C1c C 20.5253 -16.1375
2 C6a C 21.7110 -15.4528
3 O6a O 22.9085 -16.1439
4 O6a O 21.7110 -14.0470
5 C8x C 15.6503 -16.1528
6 C8y C 15.6503 -17.5568
7 C8x C 16.8662 -18.2589
8 C8x C 18.0821 -17.5568
9 C8y C 18.0821 -16.1528
10 C8y C 16.8662 -15.4509
11 X Cl 14.4344 -18.2589
12 X Cl 16.8662 -14.0468
13 O2a O 19.3167 -15.4398
14 C1a C 20.5259 -17.5699
BOND 14
1 2 3 1
2 2 4 2
3 1 2 1
4 5 6 2
5 6 7 1
6 7 8 2
7 8 9 1
8 9 10 2
9 5 10 1
10 6 11 1
11 10 12 1
12 9 13 1
13 1 13 1
14 1 14 1 #Up
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