KEGG   DRUG: Chlorpyrifos
Entry
D07688                      Drug                                   
Name
Chlorpyrifos (BAN);
Zodiac (TN)
Formula
C9H11Cl3NO3PS
Exact mass
348.9263
Mol weight
350.5863
Structure
Simcomp
Remark
Same as: C14322
Efficacy
Insecticide, Acetylcholinesterase inhibitor
Target
acetylcholinesterase (AChE) [KO:K01049]
  Pathway
ko04725  Cholinergic synapse
Brite
Classification of Japanese OTC drugs [BR:br08313]
 Agents for sanitation
  82 Pesticides
   D07688  Chlorpyrifos (BAN)
Other DBs
CAS: 2921-88-2
PubChem: 51091989
ChEBI: 34631
LigandBox: D07688
NIKKAJI: J3.041D
KCF data

ATOM        18
            1   O2b O    24.7800  -16.8700
            2   C1b C    27.2300  -15.4700
            3   C1a C    25.9700  -14.7700
            4   P1a P    25.9700  -17.5700
            5   O2b O    25.9700  -18.9700
            6   C1b C    27.1600  -19.6700
            7   C1a C    28.4200  -18.9700
            8   O2b O    27.1600  -16.8700
            9   S0  S    24.7800  -18.2700
            10  C8y C    23.5900  -17.5700
            11  C8y C    22.4000  -16.8700
            12  C8x C    21.1400  -17.5700
            13  C8y C    21.1400  -18.9700
            14  C8y C    22.3300  -19.6700
            15  N5x N    23.5900  -18.9700
            16  X   Cl   22.3300  -21.0700
            17  X   Cl   19.9500  -19.6700
            18  X   Cl   22.4000  -15.4700
BOND        18
            1     1   4 1
            2     8   2 1
            3     2   3 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     8   4 1
            8     4   9 2
            9     1  10 1
            10   10  11 2
            11   11  12 1
            12   12  13 2
            13   13  14 1
            14   14  15 2
            15   10  15 1
            16   14  16 1
            17   13  17 1
            18   11  18 1

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