KEGG   COMPOUND: C11090
Entry
C11090                      Compound                               
Name
Endosulfan;
Benzoepin
Formula
C9H6Cl6O3S
Exact mass
403.8169
Mol weight
406.9251
Structure
Brite
Endocrine disrupting compounds [BR:br08006]
 Pesticides and herbicides
  Organochlorine pesticides
   C11090  Endosulfan
Pesticides [BR:br08007]
 Pesticides
  Insecticides
   Organochlorine insecticides
    C11090  Endosulfan
Other DBs
CAS: 115-29-7
PubChem: 13272
ChEBI: 4791
PDB-CCD: S68[PDBj]
NIKKAJI: J2.897E
KCF data

ATOM        19
            1   C1z C    26.9603  -16.2671
            2   C1z C    27.6084  -15.2883
            3   C2y C    25.7489  -16.9081
            4   C1y C    29.0350  -16.4363
            5   X   Cl   26.3520  -15.2675
            6   C1z C    27.6084  -17.3564
            7   X   Cl   27.1648  -14.2075
            8   X   Cl   28.5909  -14.6512
            9   C2y C    26.3900  -18.2441
            10  C1y C    29.0667  -17.7576
            11  C1x C    30.0618  -15.6049
            12  C1x C    30.0605  -18.5823
            13  O2x O    31.3567  -15.8951
            14  O2x O    31.3578  -18.2963
            15  S2x S    31.9257  -17.0935
            16  O3c O    33.2570  -17.0922
            17  X   Cl   24.5145  -16.5119
            18  X   Cl   26.0408  -19.6795
            19  X   Cl   27.4216  -18.6863
BOND        21
            1     4  10 1
            2     6   9 1
            3     6  10 1
            4     1   2 1
            5     1   3 1
            6     1   4 1
            7     1   5 1
            8     2   6 1
            9    12  14 1
            10   13  15 1
            11   14  15 1
            12   15  16 2
            13    4  11 1
            14   10  12 1
            15   11  13 1
            16    2   7 1
            17    3  17 1
            18    2   8 1
            19    9  18 1
            20    3   9 2
            21    6  19 1

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