KEGG   COMPOUND: C18975
Entry
C18975                      Compound                               
Name
Demephion-O
Formula
C5H13O3PS2
Exact mass
216.0044
Mol weight
216.2587
Structure
Brite
Pesticides [BR:br08007]
 Obsolete pesticides
  Insecticides
   Organophosphorus insecticides
    C18975  Demephion-O
Other DBs
CAS: 682-80-4
PubChem: 124489647
ChEBI: 82114
KCF data

ATOM        11
            1   P1a P    25.8300  -16.8000
            2   O2b O    27.2300  -16.8000
            3   O2b O    24.4300  -16.8000
            4   S0  S    25.8300  -15.4000
            5   O2b O    25.8300  -18.2000
            6   C1b C    23.2176  -17.5000
            7   C1b C    22.0051  -16.8000
            8   S2a S    20.7927  -17.5000
            9   C1a C    19.5803  -16.8000
            10  C1a C    27.9300  -18.0124
            11  C1a C    27.0424  -18.9000
BOND        10
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     1   5 1
            5     3   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     2  10 1
            10    5  11 1

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Chemical substance (2)   
   PubChem (1)   
   ChEBI (1)   
All databases (2)   

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